(E)-N-(butylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(butylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(butylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[butylamino(sulfanylidene)methyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(butylcarbamothioyl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(butylthiocarbamoyl)-3-(3-nitrophenyl)acrylamide Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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