N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-chlorophenyl)sulfonyl-ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-chlorophenyl)sulfonyl-ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-chlorophenyl)sulfonyl-acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(4-chlorophenyl)sulfonylacetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-chlorophenyl)sulfonylacetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-chlorophenyl)sulfonyl-acetamide Formula: C20H23ClN2O5S2 MolecularWeight: 470.99002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN2O5S2/c21-16-8-10-18(11-9-16)29(25,26)15-20(24)22-17-6-5-7-19(14-17)30(27,28)23-12-3-1-2-4-13-23/h5-11,14H,1-4,12-13,15H2,(H,22,24)