(2S)-2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-N-[(4-methylphenyl)methyl]propanamide

Systemtic Name: (2S)-2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]-N-[(4-methylphenyl)methyl]propanamide Openeye Name: (2S)-2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-(p-tolylmethyl)propanamide CAS Name: (2S)-2-[(6-chloro-1H-benzimidazol-2-yl)thio]-N-[(4-methylphenyl)methyl]propanamide IUPAC Name: (2S)-2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]-N-[(4-methylphenyl)methyl]propanamide Traditional Name: (2S)-2-[(6-chloro-1H-benzimidazol-2-yl)thio]-N-(4-methylbenzyl)propionamide Formula: C18H18ClN3OS MolecularWeight: 359.87302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(C)SC2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@H](C)SC2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C18H18ClN3OS/c1-11-3-5-13(6-4-11)10-20-17(23)12(2)24-18-21-15-8-7-14(19)9-16(15)22-18/h3-9,12H,10H2,1-2H3,(H,20,23)(H,21,22)/t12-/m0/s1