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

Systemtic Name: 2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanenitrile Openeye Name: 2-(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanylacetonitrile CAS Name: 2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]acetonitrile IUPAC Name: 2-(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanylacetonitrile Traditional Name: 2-[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]acetonitrile Formula: C16H12ClN3S MolecularWeight: 313.80458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2SCC#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2SCC#N

InChI

InChI=1S/C16H12ClN3S/c17-13-6-7-15-14(10-13)19-16(21-9-8-18)20(15)11-12-4-2-1-3-5-12/h1-7,10H,9,11H2