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

Systemtic Name: 5-(4-methylphenyl)-3-[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-methylphenyl)-3-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-methylphenyl)-3-[2-oxo-2-(1H-pyrrol-2-yl)ethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-keto-2-(1H-pyrrol-2-yl)ethyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C19H15N3O2S MolecularWeight: 349.4063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)C4=CC=CN4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)C4=CC=CN4

InChI

InChI=1S/C19H15N3O2S/c1-12-4-6-13(7-5-12)14-10-25-18-17(14)19(24)22(11-21-18)9-16(23)15-3-2-8-20-15/h2-8,10-11,20H,9H2,1H3