(E)-N-(4-methylpiperidin-1-yl)carbothioyl-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(4-methylpiperidin-1-yl)carbothioyl-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(4-methylpiperidine-1-carbothioyl)-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(4-methylpiperidine-1-carbothioyl)-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(4-methylpiperidine-1-carbothioyl)-3-(4-nitrophenyl)acrylamide Formula: C16H19N3O3S MolecularWeight: 333.40536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=S)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O3S/c1-12-8-10-18(11-9-12)16(23)17-15(20)7-4-13-2-5-14(6-3-13)19(21)22/h2-7,12H,8-11H2,1H3,(H,17,20,23)/b7-4+