3-(3,4-dimethylphenyl)sulfanyl-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]propanamide Openeye Name: 3-(3,4-dimethylphenyl)sulfanyl-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]propanamide CAS Name: 3-[(3,4-dimethylphenyl)thio]-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]propanamide IUPAC Name: 3-(3,4-dimethylphenyl)sulfanyl-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]propanamide Traditional Name: 3-[(3,4-dimethylphenyl)thio]-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]propionamide Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)N(C)C(C)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)N(C)[C@H](C)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C20H24N2O3S/c1-14-8-9-19(12-15(14)2)26-11-10-20(23)21(4)16(3)17-6-5-7-18(13-17)22(24)25/h5-9,12-13,16H,10-11H2,1-4H3/t16-/m1/s1