(E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-chlorophenyl)prop-2-enamide

Systemtic Name: (E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-chlorophenyl)prop-2-enamide Openeye Name: (E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-chlorophenyl)prop-2-enamide CAS Name: (E)-N-[3-(1-azepanylsulfonyl)phenyl]-3-(3-chlorophenyl)-2-propenamide IUPAC Name: (E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-chlorophenyl)prop-2-enamide Traditional Name: (E)-N-[3-(azepan-1-ylsulfonyl)phenyl]-3-(3-chlorophenyl)acrylamide Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C=CC3=CC(=CC=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN2O3S/c22-18-8-5-7-17(15-18)11-12-21(25)23-19-9-6-10-20(16-19)28(26,27)24-13-3-1-2-4-14-24/h5-12,15-16H,1-4,13-14H2,(H,23,25)/b12-11+