3H-benzimidazol-5-yl-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: 3H-benzimidazol-5-yl-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: 3H-benzimidazol-5-yl-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]methanone CAS Name: 3H-benzimidazol-5-yl-[4-[[4-(methylthio)phenyl]methyl]-1-piperazinyl]methanone IUPAC Name: 3H-benzimidazol-5-yl-[4-[(4-methylsulfanylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: 3H-benzimidazol-5-yl-[4-[4-(methylthio)benzyl]piperazino]methanone Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=CN4

Isomeric SMILES

CSC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=CN4

InChI

InChI=1S/C20H22N4OS/c1-26-17-5-2-15(3-6-17)13-23-8-10-24(11-9-23)20(25)16-4-7-18-19(12-16)22-14-21-18/h2-7,12,14H,8-11,13H2,1H3,(H,21,22)