(E)-N-[(4-methylphenyl)methylcarbamothioyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(4-methylphenyl)methylcarbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-(p-tolylmethylcarbamothioyl)prop-2-enamide CAS Name: (E)-N-[[(4-methylphenyl)methylamino]-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(4-methylphenyl)methylcarbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(4-methylbenzyl)thiocarbamoyl]-3-(3-nitrophenyl)acrylamide Formula: C18H17N3O3S MolecularWeight: 355.41088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=S)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=S)NC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3S/c1-13-5-7-15(8-6-13)12-19-18(25)20-17(22)10-9-14-3-2-4-16(11-14)21(23)24/h2-11H,12H2,1H3,(H2,19,20,22,25)/b10-9+