4-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]benzonitrile CAS Name: 4-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]benzonitrile IUPAC Name: 4-[(6-methyl-1H-benzimidazol-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(6-methyl-1H-benzimidazol-2-yl)thio]methyl]benzonitrile Formula: C16H13N3S MolecularWeight: 279.35952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SCC3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)SCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13N3S/c1-11-2-7-14-15(8-11)19-16(18-14)20-10-13-5-3-12(9-17)4-6-13/h2-8H,10H2,1H3,(H,18,19)