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

Systemtic Name: (E)-3-(3-nitrophenyl)-N-(propylcarbamothioyl)prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-(propylcarbamothioyl)prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[propylamino(sulfanylidene)methyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-(propylcarbamothioyl)prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-N-(propylthiocarbamoyl)acrylamide Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O3S/c1-2-8-14-13(20)15-12(17)7-6-10-4-3-5-11(9-10)16(18)19/h3-7,9H,2,8H2,1H3,(H2,14,15,17,20)/b7-6+