3-[2-[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]propanenitrile

Systemtic Name: 3-[2-[2-(5-chloranylthiophen-2-yl)-2-oxidanylidene-ethyl]sulfanylbenzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-[2-(5-chloro-2-thienyl)-2-oxo-ethyl]sulfanylbenzimidazol-1-yl]propanenitrile CAS Name: 3-[2-[[2-(5-chloro-2-thiophenyl)-2-oxoethyl]thio]-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-[2-(5-chlorothiophen-2-yl)-2-oxoethyl]sulfanylbenzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-[[2-(5-chloro-2-thienyl)-2-keto-ethyl]thio]benzimidazol-1-yl]propionitrile Formula: C16H12ClN3OS2 MolecularWeight: 361.86898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H12ClN3OS2/c17-15-7-6-14(23-15)13(21)10-22-16-19-11-4-1-2-5-12(11)20(16)9-3-8-18/h1-2,4-7H,3,9-10H2