(E)-N-[(2,4-dimethyl-6-nitro-phenyl)carbamothioyl]-3-thiophen-2-yl-prop-2-enamide

Systemtic Name: (E)-N-[(2,4-dimethyl-6-nitro-phenyl)carbamothioyl]-3-thiophen-2-yl-prop-2-enamide Openeye Name: (E)-N-[(2,4-dimethyl-6-nitro-phenyl)carbamothioyl]-3-(2-thienyl)prop-2-enamide CAS Name: (E)-N-[(2,4-dimethyl-6-nitroanilino)-sulfanylidenemethyl]-3-thiophen-2-yl-2-propenamide IUPAC Name: (E)-N-[(2,4-dimethyl-6-nitrophenyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide Traditional Name: (E)-N-[(2,4-dimethyl-6-nitro-phenyl)thiocarbamoyl]-3-(2-thienyl)acrylamide Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(=S)NC(=O)C=CC2=CC=CS2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(=S)NC(=O)/C=C/C2=CC=CS2)C

InChI

InChI=1S/C16H15N3O3S2/c1-10-8-11(2)15(13(9-10)19(21)22)18-16(23)17-14(20)6-5-12-4-3-7-24-12/h3-9H,1-2H3,(H2,17,18,20,23)/b6-5+