3-cyclohexylsulfanyl-N-(2-methyl-5-nitro-phenyl)propanamide

Systemtic Name: 3-cyclohexylsulfanyl-N-(2-methyl-5-nitro-phenyl)propanamide Openeye Name: 3-cyclohexylsulfanyl-N-(2-methyl-5-nitro-phenyl)propanamide CAS Name: 3-(cyclohexylthio)-N-(2-methyl-5-nitrophenyl)propanamide IUPAC Name: 3-cyclohexylsulfanyl-N-(2-methyl-5-nitrophenyl)propanamide Traditional Name: 3-(cyclohexylthio)-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCSC2CCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCSC2CCCCC2

InChI

InChI=1S/C16H22N2O3S/c1-12-7-8-13(18(20)21)11-15(12)17-16(19)9-10-22-14-5-3-2-4-6-14/h7-8,11,14H,2-6,9-10H2,1H3,(H,17,19)