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

Systemtic Name: 3-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]-5-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]-5-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-(1H-pyrrol-2-yl)ethyl]-5-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C18H13N3O2S MolecularWeight: 335.37972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13N3O2S/c22-15(14-7-4-8-19-14)9-21-11-20-17-16(18(21)23)13(10-24-17)12-5-2-1-3-6-12/h1-8,10-11,19H,9H2