2-[2-(2-methylpyrrolidin-1-yl)ethyl]-6-(4-methylsulfanylphenyl)-1H-benzimidazole

Systemtic Name: 2-[2-(2-methylpyrrolidin-1-yl)ethyl]-6-(4-methylsulfanylphenyl)-1H-benzimidazole Openeye Name: 2-[2-(2-methylpyrrolidin-1-yl)ethyl]-6-(4-methylsulfanylphenyl)-1H-benzimidazole CAS Name: 2-[2-(2-methyl-1-pyrrolidinyl)ethyl]-6-[4-(methylthio)phenyl]-1H-benzimidazole IUPAC Name: 2-[2-(2-methylpyrrolidin-1-yl)ethyl]-6-(4-methylsulfanylphenyl)-1H-benzimidazole Traditional Name: 2-[2-(2-methylpyrrolidino)ethyl]-6-[4-(methylthio)phenyl]-1H-benzimidazole Formula: C21H25N3S MolecularWeight: 351.5083

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN1CCC2=NC3=C(N2)C=C(C=C3)C4=CC=C(C=C4)SC

Isomeric SMILES

CC1CCCN1CCC2=NC3=C(N2)C=C(C=C3)C4=CC=C(C=C4)SC

InChI

InChI=1S/C21H25N3S/c1-15-4-3-12-24(15)13-11-21-22-19-10-7-17(14-20(19)23-21)16-5-8-18(25-2)9-6-16/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,22,23)