(E)-N-(azepan-1-ylcarbothioyl)-3-(2-chlorophenyl)prop-2-enamide

Systemtic Name: (E)-N-(azepan-1-ylcarbothioyl)-3-(2-chlorophenyl)prop-2-enamide Openeye Name: (E)-N-(azepane-1-carbothioyl)-3-(2-chlorophenyl)prop-2-enamide CAS Name: (E)-N-[1-azepanyl(sulfanylidene)methyl]-3-(2-chlorophenyl)-2-propenamide IUPAC Name: (E)-N-(azepane-1-carbothioyl)-3-(2-chlorophenyl)prop-2-enamide Traditional Name: (E)-N-(azepane-1-carbothioyl)-3-(2-chlorophenyl)acrylamide Formula: C16H19ClN2OS MolecularWeight: 322.85286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC(=O)C=CC2=CC=CC=C2Cl

Isomeric SMILES

C1CCCN(CC1)C(=S)NC(=O)/C=C/C2=CC=CC=C2Cl

InChI

InChI=1S/C16H19ClN2OS/c17-14-8-4-3-7-13(14)9-10-15(20)18-16(21)19-11-5-1-2-6-12-19/h3-4,7-10H,1-2,5-6,11-12H2,(H,18,20,21)/b10-9+