2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[2-oxo-2-(1H-pyrrol-2-yl)ethyl]thio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]sulfanyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(1H-pyrrol-2-yl)ethyl]thio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H13N3O2S2 MolecularWeight: 367.44472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCC(=O)C4=CC=CN4

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)NC(=N3)SCC(=O)C4=CC=CN4

InChI

InChI=1S/C18H13N3O2S2/c22-14(13-7-4-8-19-13)10-25-18-20-16(23)15-12(9-24-17(15)21-18)11-5-2-1-3-6-11/h1-9,19H,10H2,(H,20,21,23)