N-(4-bromanyl-2-methyl-phenyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanylacetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]acetamide Formula: C17H17BrN2O3S MolecularWeight: 409.29748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrN2O3S/c1-11-8-14(18)6-7-16(11)19-17(21)10-24-12(2)13-4-3-5-15(9-13)20(22)23/h3-9,12H,10H2,1-2H3,(H,19,21)/t12-/m1/s1