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

Systemtic Name: N-[2-[(2-chlorophenyl)methylsulfanyl]-1-propan-2-yl-benzimidazol-5-yl]cyclopropanecarboxamide Openeye Name: N-[2-[(2-chlorophenyl)methylsulfanyl]-1-isopropyl-benzimidazol-5-yl]cyclopropanecarboxamide CAS Name: N-[2-[(2-chlorophenyl)methylthio]-1-propan-2-yl-5-benzimidazolyl]cyclopropanecarboxamide IUPAC Name: N-[2-[(2-chlorophenyl)methylsulfanyl]-1-propan-2-ylbenzimidazol-5-yl]cyclopropanecarboxamide Traditional Name: N-[2-[(2-chlorobenzyl)thio]-1-isopropyl-benzimidazol-5-yl]cyclopropanecarboxamide Formula: C21H22ClN3OS MolecularWeight: 399.93688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)NC(=O)C3CC3)N=C1SCC4=CC=CC=C4Cl

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)NC(=O)C3CC3)N=C1SCC4=CC=CC=C4Cl

InChI

InChI=1S/C21H22ClN3OS/c1-13(2)25-19-10-9-16(23-20(26)14-7-8-14)11-18(19)24-21(25)27-12-15-5-3-4-6-17(15)22/h3-6,9-11,13-14H,7-8,12H2,1-2H3,(H,23,26)