(E)-3-(5-methylfuran-2-yl)-N-[(3-nitrophenyl)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(5-methylfuran-2-yl)-N-[(3-nitrophenyl)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(5-methyl-2-furyl)-N-[(3-nitrophenyl)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(5-methyl-2-furanyl)-N-[(3-nitroanilino)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(5-methylfuran-2-yl)-N-[(3-nitrophenyl)carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(5-methyl-2-furyl)-N-[(3-nitrophenyl)thiocarbamoyl]acrylamide Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=CC(=O)NC(=S)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)/C=C/C(=O)NC(=S)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O4S/c1-10-5-6-13(22-10)7-8-14(19)17-15(23)16-11-3-2-4-12(9-11)18(20)21/h2-9H,1H3,(H2,16,17,19,23)/b8-7+