(E)-N-(butan-2-ylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(butan-2-ylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-(sec-butylcarbamothioyl)prop-2-enamide CAS Name: (E)-N-[(butan-2-ylamino)-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(butan-2-ylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-N-(sec-butylthiocarbamoyl)acrylamide Formula: C14H17N3O3S MolecularWeight: 307.36808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3S/c1-3-10(2)15-14(21)16-13(18)8-7-11-5-4-6-12(9-11)17(19)20/h4-10H,3H2,1-2H3,(H2,15,16,18,21)/b8-7+