N-tert-butyl-2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: N-tert-butyl-2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanyl-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanyl-N-tert-butylacetamide Traditional Name: N-benzyl-2-[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]-N-tert-butyl-acetamide Formula: C27H28ClN3OS MolecularWeight: 478.04872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

Isomeric SMILES

CC(C)(C)N(CC1=CC=CC=C1)C(=O)CSC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl

InChI

InChI=1S/C27H28ClN3OS/c1-27(2,3)31(18-21-12-8-5-9-13-21)25(32)19-33-26-29-23-16-22(28)14-15-24(23)30(26)17-20-10-6-4-7-11-20/h4-16H,17-19H2,1-3H3