N-(2,5-dimethylphenyl)-2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[[(1S)-1-(3-nitrophenyl)ethyl]thio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(1S)-1-(3-nitrophenyl)ethyl]sulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[[(1S)-1-(3-nitrophenyl)ethyl]thio]acetamide Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S/c1-12-7-8-13(2)17(9-12)19-18(21)11-24-14(3)15-5-4-6-16(10-15)20(22)23/h4-10,14H,11H2,1-3H3,(H,19,21)/t14-/m0/s1