2-imidazo[1,5-a]pyridin-3-ylsulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-imidazo[1,5-a]pyridin-3-ylsulfanyl-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-imidazo[1,5-a]pyridin-3-ylsulfanyl-ethanone CAS Name: 2-(3-imidazo[1,5-a]pyridinylthio)-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-imidazo[1,5-a]pyridin-3-ylsulfanylethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(imidazo[1,5-a]pyridin-3-ylthio)ethanone Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CSC2=NC=C3N2C=CC=C3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)CSC2=NC=C3N2C=CC=C3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O3S2/c25-19(15-28-20-21-14-18-8-4-5-9-24(18)20)22-10-12-23(13-11-22)29(26,27)16-17-6-2-1-3-7-17/h1-9,14H,10-13,15-16H2