N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-ethanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-acetamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]acetamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-2-[(1R)-1-(3-nitrophenyl)ethyl]sulfanylacetamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-2-[[(1R)-1-(3-nitrophenyl)ethyl]thio]acetamide Formula: C18H19ClN2O3S MolecularWeight: 378.87306

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN2O3S/c1-11-7-12(2)18(16(19)8-11)20-17(22)10-25-13(3)14-5-4-6-15(9-14)21(23)24/h4-9,13H,10H2,1-3H3,(H,20,22)/t13-/m1/s1