methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-thieno[2,3-d]pyrimidin-4-ylsulfanyl-butanoate

Systemtic Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-thieno[2,3-d]pyrimidin-4-ylsulfanyl-butanoate Openeye Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-thieno[2,3-d]pyrimidin-4-ylsulfanyl-butanoate CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(4-thieno[2,3-d]pyrimidinylthio)butanoic acid methyl ester IUPAC Name: methyl 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-thieno[2,3-d]pyrimidin-4-ylsulfanylbutanoate Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-(thieno[2,3-d]pyrimidin-4-ylthio)butyric acid methyl ester Formula: C18H14N4O3S2 MolecularWeight: 398.45876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

COC(=O)C(=C1NC2=CC=CC=C2N1)C(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C18H14N4O3S2/c1-25-18(24)14(15-21-11-4-2-3-5-12(11)22-15)13(23)8-27-17-10-6-7-26-16(10)19-9-20-17/h2-7,9,21-22H,8H2,1H3