2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-oxidanylidene-butanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(2-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-[[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]thio]butyronitrile Formula: C22H15N5OS3 MolecularWeight: 461.5824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC=CS3)C(=N1)SCC(=O)C(=C4NC5=CC=CC=C5N4)C#N

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC=CS3)C(=N1)SCC(=O)C(=C4NC5=CC=CC=C5N4)C#N

InChI

InChI=1S/C22H15N5OS3/c1-12-24-21-19(14(10-30-21)18-7-4-8-29-18)22(25-12)31-11-17(28)13(9-23)20-26-15-5-2-3-6-16(15)27-20/h2-8,10,26-27H,11H2,1H3