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

Systemtic Name: (E)-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[(3-chloro-4-methyl-phenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[(3-chloro-4-methylanilino)-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(3-chloro-4-methylphenyl)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(3-chloro-4-methyl-phenyl)thiocarbamoyl]-3-(3-nitrophenyl)acrylamide Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClN3O3S/c1-11-5-7-13(10-15(11)18)19-17(25)20-16(22)8-6-12-3-2-4-14(9-12)21(23)24/h2-10H,1H3,(H2,19,20,22,25)/b8-6+