2-(methylsulfanylmethyl)-6-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-benzimidazole

Systemtic Name: 2-(methylsulfanylmethyl)-6-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-benzimidazole Openeye Name: 2-(methylsulfanylmethyl)-6-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-benzimidazole CAS Name: 2-[(methylthio)methyl]-6-[2-(4-phenyl-1-piperazinyl)ethyl]-1H-benzimidazole IUPAC Name: 2-(methylsulfanylmethyl)-6-[2-(4-phenylpiperazin-1-yl)ethyl]-1H-benzimidazole Traditional Name: 2-[(methylthio)methyl]-6-[2-(4-phenylpiperazino)ethyl]-1H-benzimidazole Formula: C21H26N4S MolecularWeight: 366.52294

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=NC2=C(N1)C=C(C=C2)CCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CSCC1=NC2=C(N1)C=C(C=C2)CCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N4S/c1-26-16-21-22-19-8-7-17(15-20(19)23-21)9-10-24-11-13-25(14-12-24)18-5-3-2-4-6-18/h2-8,15H,9-14,16H2,1H3,(H,22,23)