4-[(1-phenethylbenzimidazol-2-yl)sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(1-phenethylbenzimidazol-2-yl)sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[(1-phenethylbenzimidazol-2-yl)sulfanylmethyl]benzonitrile CAS Name: 4-[[(1-phenethyl-2-benzimidazolyl)thio]methyl]benzonitrile IUPAC Name: 4-[(1-phenethylbenzimidazol-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 4-[[(1-phenethylbenzimidazol-2-yl)thio]methyl]benzonitrile Formula: C23H19N3S MolecularWeight: 369.48206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H19N3S/c24-16-19-10-12-20(13-11-19)17-27-23-25-21-8-4-5-9-22(21)26(23)15-14-18-6-2-1-3-7-18/h1-13H,14-15,17H2