N-[2-[(2-methylphenyl)methylsulfanyl]-1-propan-2-yl-benzimidazol-5-yl]cyclopropanecarboxamide

Systemtic Name: N-[2-[(2-methylphenyl)methylsulfanyl]-1-propan-2-yl-benzimidazol-5-yl]cyclopropanecarboxamide Openeye Name: N-[1-isopropyl-2-(o-tolylmethylsulfanyl)benzimidazol-5-yl]cyclopropanecarboxamide CAS Name: N-[2-[(2-methylphenyl)methylthio]-1-propan-2-yl-5-benzimidazolyl]cyclopropanecarboxamide IUPAC Name: N-[2-[(2-methylphenyl)methylsulfanyl]-1-propan-2-ylbenzimidazol-5-yl]cyclopropanecarboxamide Traditional Name: N-[1-isopropyl-2-[(2-methylbenzyl)thio]benzimidazol-5-yl]cyclopropanecarboxamide Formula: C22H25N3OS MolecularWeight: 379.5184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)C4CC4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)C4CC4

InChI

InChI=1S/C22H25N3OS/c1-14(2)25-20-11-10-18(23-21(26)16-8-9-16)12-19(20)24-22(25)27-13-17-7-5-4-6-15(17)3/h4-7,10-12,14,16H,8-9,13H2,1-3H3,(H,23,26)