(E)-3-(3-nitrophenyl)-N-[(2,4,6-trimethylphenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(3-nitrophenyl)-N-[(2,4,6-trimethylphenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-[(2,4,6-trimethylphenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[sulfanylidene-(2,4,6-trimethylanilino)methyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-[(2,4,6-trimethylphenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-N-(mesitylthiocarbamoyl)-3-(3-nitrophenyl)acrylamide Formula: C19H19N3O3S MolecularWeight: 369.43746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O3S/c1-12-9-13(2)18(14(3)10-12)21-19(26)20-17(23)8-7-15-5-4-6-16(11-15)22(24)25/h4-11H,1-3H3,(H2,20,21,23,26)/b8-7+