(E)-N-[(cyclohexylcarbonylamino)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(cyclohexylcarbonylamino)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[(cyclohexanecarbonylamino)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[[[cyclohexyl(oxo)methyl]hydrazo]-sulfanylidenemethyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[(cyclohexanecarbonylamino)carbamothioyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[(cyclohexanecarbonylamino)thiocarbamoyl]-3-(3-nitrophenyl)acrylamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NNC(=S)NC(=O)C=CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)C(=O)NNC(=S)NC(=O)/C=C/C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4S/c22-15(10-9-12-5-4-8-14(11-12)21(24)25)18-17(26)20-19-16(23)13-6-2-1-3-7-13/h4-5,8-11,13H,1-3,6-7H2,(H,19,23)(H2,18,20,22,26)/b10-9+