3-cyclohexyl-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]propanamide Openeye Name: 3-cyclohexyl-N-[(2-methyl-5-nitro-phenyl)carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[(2-methyl-5-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[(2-methyl-5-nitrophenyl)carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[(2-methyl-5-nitro-phenyl)thiocarbamoyl]propionamide Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)CCC2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=S)NC(=O)CCC2CCCCC2

InChI

InChI=1S/C17H23N3O3S/c1-12-7-9-14(20(22)23)11-15(12)18-17(24)19-16(21)10-8-13-5-3-2-4-6-13/h7,9,11,13H,2-6,8,10H2,1H3,(H2,18,19,21,24)