(E)-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(2-ethyl-6-methylphenyl)carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl]-3-(4-nitrophenyl)acrylamide Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C19H19N3O3S/c1-3-15-6-4-5-13(2)18(15)21-19(26)20-17(23)12-9-14-7-10-16(11-8-14)22(24)25/h4-12H,3H2,1-2H3,(H2,20,21,23,26)/b12-9+