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The Drug-Drug Interactions Ontology
Last uploaded:
February 11, 2016
| Id | http://purl.obolibrary.org/obo/dinto_DB07216
http://purl.obolibrary.org/obo/dinto_DB07216
|
|---|---|
| Preferred Name | (11s)-8-chloro-11-[1-(methylsulfonyl)piperidin-4-yl]-6-piperazin-1-yl-11h-benzo[5,6]cyclohepta[1,2-b]pyridine |
| Synonyms |
(2S)-13-chloro-2-(1-methanesulfonylpiperidin-4-yl)-10-(piperazin-1-yl)-4-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaene
C24H29ClN4O2S
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| prefLabel | (11s)-8-chloro-11-[1-(methylsulfonyl)piperidin-4-yl]-6-piperazin-1-yl-11h-benzo[5,6]cyclohepta[1,2-b]pyridine
|
|---|---|
| label | (11s)-8-chloro-11-[1-(methylsulfonyl)piperidin-4-yl]-6-piperazin-1-yl-11h-benzo[5,6]cyclohepta[1,2-b]pyridine
|
| type | |
| InChIKey | InChIKey=ZMGCFGGMTCMSDP-QHCPKHFHSA-N
|
| Synonym | (2S)-13-chloro-2-(1-methanesulfonylpiperidin-4-yl)-10-(piperazin-1-yl)-4-azatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaene
C24H29ClN4O2S
|
| xref |
PubChem Substance:99443687
ChemSpider:7826847
PDB:736
PubChem Compound:9547909
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| prefixIRI | obo2:dinto_DB07216
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| related with | |
| SMILES | [H][C@]1(C2CCN(CC2)S(C)(=O)=O)C2=C(C=C(Cl)C=C2)C(=CC2=C1N=CC=C2)N1CCNCC1
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| InChI | InChI=1S/C24H29ClN4O2S/c1-32(30,31)29-11-6-17(7-12-29)23-20-5-4-19(25)16-21(20)22(28-13-9-26-10-14-28)15-18-3-2-8-27-24(18)23/h2-5,8,15-17,23,26H,6-7,9-14H2,1H3/t23-/m0/s1
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| subClassOf |
| Delete | Subject | Author | Type | Created |
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