(E)-N-[[3-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[[3-(4-methylpiperidin-1-yl)carbonylphenyl]carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[[3-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[[3-[(4-methyl-1-piperidinyl)-oxomethyl]anilino]-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[[3-(4-methylpiperidine-1-carbonyl)phenyl]carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[[3-(4-methylpiperidine-1-carbonyl)phenyl]thiocarbamoyl]-3-(3-nitrophenyl)acrylamide Formula: C23H24N4O4S MolecularWeight: 452.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=CC(=CC=C2)NC(=S)NC(=O)/C=C/C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O4S/c1-16-10-12-26(13-11-16)22(29)18-5-3-6-19(15-18)24-23(32)25-21(28)9-8-17-4-2-7-20(14-17)27(30)31/h2-9,14-16H,10-13H2,1H3,(H2,24,25,28,32)/b9-8+