N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(3-imidazo[1,5-a]pyridinylthio)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-imidazo[1,5-a]pyridin-3-ylsulfanylacetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(imidazo[1,5-a]pyridin-3-ylthio)acetamide Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CSC3=NC=C4N3C=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)NC(=O)CSC3=NC=C4N3C=CC=C4

InChI

InChI=1S/C22H26N4O4S2/c1-30-20-10-9-18(32(28,29)25-11-5-2-3-6-12-25)14-19(20)24-21(27)16-31-22-23-15-17-8-4-7-13-26(17)22/h4,7-10,13-15H,2-3,5-6,11-12,16H2,1H3,(H,24,27)