N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[(1S)-1-(2-methoxy-5-methylphenyl)ethyl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-[(1S)-1-(2-methoxy-5-methyl-phenyl)ethyl]-2-[(4-nitrophenyl)thio]acetamide Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC)[C@H](C)NC(=O)CSC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O4S/c1-12-4-9-17(24-3)16(10-12)13(2)19-18(21)11-25-15-7-5-14(6-8-15)20(22)23/h4-10,13H,11H2,1-3H3,(H,19,21)/t13-/m0/s1