2-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanylmethyl]benzonitrile CAS Name: 2-[[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]methyl]benzonitrile IUPAC Name: 2-[(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanylmethyl]benzonitrile Traditional Name: 2-[[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]methyl]benzonitrile Formula: C22H16ClN3S MolecularWeight: 389.90054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2SCC4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2SCC4=CC=CC=C4C#N

InChI

InChI=1S/C22H16ClN3S/c23-19-10-11-21-20(12-19)25-22(26(21)14-16-6-2-1-3-7-16)27-15-18-9-5-4-8-17(18)13-24/h1-12H,14-15H2