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

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(3-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-[(4-keto-3-methyl-thieno[2,3-d]pyrimidin-2-yl)thio]butyronitrile Formula: C18H13N5O2S2 MolecularWeight: 395.45812

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N)SC=C2

InChI

InChI=1S/C18H13N5O2S2/c1-23-17(25)10-6-7-26-16(10)22-18(23)27-9-14(24)11(8-19)15-20-12-4-2-3-5-13(12)21-15/h2-7,20-21H,9H2,1H3