2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanyl-N-(3-chloranyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanyl-N-(3-chloranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanyl-N-(3-chloro-4-methyl-phenyl)acetamide CAS Name: 2-[[(1R)-1-(1H-benzimidazol-2-yl)ethyl]thio]-N-(3-chloro-4-methylphenyl)acetamide IUPAC Name: 2-[(1R)-1-(1H-benzimidazol-2-yl)ethyl]sulfanyl-N-(3-chloro-4-methylphenyl)acetamide Traditional Name: 2-[[(1R)-1-(1H-benzimidazol-2-yl)ethyl]thio]-N-(3-chloro-4-methyl-phenyl)acetamide Formula: C18H18ClN3OS MolecularWeight: 359.87302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC(C)C2=NC3=CC=CC=C3N2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CS[C@H](C)C2=NC3=CC=CC=C3N2)Cl

InChI

InChI=1S/C18H18ClN3OS/c1-11-7-8-13(9-14(11)19)20-17(23)10-24-12(2)18-21-15-5-3-4-6-16(15)22-18/h3-9,12H,10H2,1-2H3,(H,20,23)(H,21,22)/t12-/m1/s1