N-(2-bromanyl-4-methyl-phenyl)-2-[6-chloranyl-1-[(1S)-1-phenylethyl]benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[6-chloranyl-1-[(1S)-1-phenylethyl]benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[6-chloro-1-[(1S)-1-phenylethyl]benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[[6-chloro-1-[(1S)-1-phenylethyl]-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[6-chloro-1-[(1S)-1-phenylethyl]benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[[6-chloro-1-[(1S)-1-phenylethyl]benzimidazol-2-yl]thio]acetamide Formula: C24H21BrClN3OS MolecularWeight: 514.86504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(N2C(C)C4=CC=CC=C4)C=C(C=C3)Cl)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=C(N2[C@@H](C)C4=CC=CC=C4)C=C(C=C3)Cl)Br

InChI

InChI=1S/C24H21BrClN3OS/c1-15-8-10-20(19(25)12-15)27-23(30)14-31-24-28-21-11-9-18(26)13-22(21)29(24)16(2)17-6-4-3-5-7-17/h3-13,16H,14H2,1-2H3,(H,27,30)/t16-/m0/s1