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

Systemtic Name: 3-[2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanylbenzimidazol-1-yl]propanenitrile Openeye Name: 3-[2-[2-oxo-2-(2-thienyl)ethyl]sulfanylbenzimidazol-1-yl]propanenitrile CAS Name: 3-[2-[(2-oxo-2-thiophen-2-ylethyl)thio]-1-benzimidazolyl]propanenitrile IUPAC Name: 3-[2-(2-oxo-2-thiophen-2-ylethyl)sulfanylbenzimidazol-1-yl]propanenitrile Traditional Name: 3-[2-[[2-keto-2-(2-thienyl)ethyl]thio]benzimidazol-1-yl]propionitrile Formula: C16H13N3OS2 MolecularWeight: 327.42392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CCC#N)SCC(=O)C3=CC=CS3

InChI

InChI=1S/C16H13N3OS2/c17-8-4-9-19-13-6-2-1-5-12(13)18-16(19)22-11-14(20)15-7-3-10-21-15/h1-3,5-7,10H,4,9,11H2