3-cyclohexyl-N-[(4-nitrophenyl)carbamothioyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[(4-nitrophenyl)carbamothioyl]propanamide Openeye Name: 3-cyclohexyl-N-[(4-nitrophenyl)carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[(4-nitroanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[(4-nitrophenyl)carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[(4-nitrophenyl)thiocarbamoyl]propionamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC(=S)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O3S/c20-15(11-6-12-4-2-1-3-5-12)18-16(23)17-13-7-9-14(10-8-13)19(21)22/h7-10,12H,1-6,11H2,(H2,17,18,20,23)