N-[(1S)-3-methyl-1-phenyl-butyl]-2-(4-nitrophenyl)sulfanyl-ethanamide

Systemtic Name: N-[(1S)-3-methyl-1-phenyl-butyl]-2-(4-nitrophenyl)sulfanyl-ethanamide Openeye Name: N-[(1S)-3-methyl-1-phenyl-butyl]-2-(4-nitrophenyl)sulfanyl-acetamide CAS Name: N-[(1S)-3-methyl-1-phenylbutyl]-2-[(4-nitrophenyl)thio]acetamide IUPAC Name: N-[(1S)-3-methyl-1-phenylbutyl]-2-(4-nitrophenyl)sulfanylacetamide Traditional Name: N-[(1S)-3-methyl-1-phenyl-butyl]-2-[(4-nitrophenyl)thio]acetamide Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O3S/c1-14(2)12-18(15-6-4-3-5-7-15)20-19(22)13-25-17-10-8-16(9-11-17)21(23)24/h3-11,14,18H,12-13H2,1-2H3,(H,20,22)/t18-/m0/s1