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

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3-ethyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxidanylidene-butanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3-ethyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxo-butanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(3-ethyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-3-oxobutanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-(3-ethyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-3-oxobutanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-4-[(3-ethyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-3-keto-butyronitrile Formula: C25H19N5O2S2 MolecularWeight: 485.58066

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N)SC=C2C5=CC=CC=C5

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC(=O)C(=C3NC4=CC=CC=C4N3)C#N)SC=C2C5=CC=CC=C5

InChI

InChI=1S/C25H19N5O2S2/c1-2-30-24(32)21-17(15-8-4-3-5-9-15)13-33-23(21)29-25(30)34-14-20(31)16(12-26)22-27-18-10-6-7-11-19(18)28-22/h3-11,13,27-28H,2,14H2,1H3