N-[2-(cyclohexen-1-yl)ethyl]-3-methyl-2-[(4-methylphenyl)methylsulfanyl]benzimidazole-5-carboxamide

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-3-methyl-2-[(4-methylphenyl)methylsulfanyl]benzimidazole-5-carboxamide Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-3-methyl-2-(p-tolylmethylsulfanyl)benzimidazole-5-carboxamide CAS Name: N-[2-(1-cyclohexenyl)ethyl]-3-methyl-2-[(4-methylphenyl)methylthio]-5-benzimidazolecarboxamide IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-3-methyl-2-[(4-methylphenyl)methylsulfanyl]benzimidazole-5-carboxamide Traditional Name: N-[2-(cyclohexen-1-yl)ethyl]-3-methyl-2-[(4-methylbenzyl)thio]benzimidazole-5-carboxamide Formula: C25H29N3OS MolecularWeight: 419.58226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(N2C)C=C(C=C3)C(=O)NCCC4=CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(N2C)C=C(C=C3)C(=O)NCCC4=CCCCC4

InChI

InChI=1S/C25H29N3OS/c1-18-8-10-20(11-9-18)17-30-25-27-22-13-12-21(16-23(22)28(25)2)24(29)26-15-14-19-6-4-3-5-7-19/h6,8-13,16H,3-5,7,14-15,17H2,1-2H3,(H,26,29)