3-cyclohexyl-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]propanamide Openeye Name: 3-cyclohexyl-N-[(4-methoxy-2-nitro-phenyl)carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[(4-methoxy-2-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[(4-methoxy-2-nitrophenyl)carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[(4-methoxy-2-nitro-phenyl)thiocarbamoyl]propionamide Formula: C17H23N3O4S MolecularWeight: 365.44722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)NC(=O)CCC2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)NC(=O)CCC2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O4S/c1-24-13-8-9-14(15(11-13)20(22)23)18-17(25)19-16(21)10-7-12-5-3-2-4-6-12/h8-9,11-12H,2-7,10H2,1H3,(H2,18,19,21,25)