(E)-N-(azepan-1-ylcarbothioyl)-3-(4-methylphenyl)prop-2-enamide

Systemtic Name: (E)-N-(azepan-1-ylcarbothioyl)-3-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-N-(azepane-1-carbothioyl)-3-(p-tolyl)prop-2-enamide CAS Name: (E)-N-[1-azepanyl(sulfanylidene)methyl]-3-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-N-(azepane-1-carbothioyl)-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-N-(azepane-1-carbothioyl)-3-(p-tolyl)acrylamide Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)NC(=S)N2CCCCCC2

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)NC(=S)N2CCCCCC2

InChI

InChI=1S/C17H22N2OS/c1-14-6-8-15(9-7-14)10-11-16(20)18-17(21)19-12-4-2-3-5-13-19/h6-11H,2-5,12-13H2,1H3,(H,18,20,21)/b11-10+