1-[6-[2-(4-chlorophenyl)sulfonylethylsulfanyl]pyridin-3-yl]sulfonylazepane

Systemtic Name: 1-[6-[2-(4-chlorophenyl)sulfonylethylsulfanyl]pyridin-3-yl]sulfonylazepane Openeye Name: 1-[[6-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-3-pyridyl]sulfonyl]azepane CAS Name: 1-[[6-[2-(4-chlorophenyl)sulfonylethylthio]-3-pyridinyl]sulfonyl]azepane IUPAC Name: 1-[6-[2-(4-chlorophenyl)sulfonylethylsulfanyl]pyridin-3-yl]sulfonylazepane Traditional Name: 1-[[6-[2-(4-chlorophenyl)sulfonylethylthio]-3-pyridyl]sulfonyl]azepane Formula: C19H23ClN2O4S3 MolecularWeight: 475.04492

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CN=C(C=C2)SCCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H23ClN2O4S3/c20-16-5-7-17(8-6-16)28(23,24)14-13-27-19-10-9-18(15-21-19)29(25,26)22-11-3-1-2-4-12-22/h5-10,15H,1-4,11-14H2