2-[5-(4-methylphenyl)-4-oxidanylidene-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-3-yl]ethanoate

Systemtic Name: 2-[5-(4-methylphenyl)-4-oxidanylidene-2-pyridin-4-yl-thieno[2,3-d]pyrimidin-3-yl]ethanoate Openeye Name: 2-[4-oxo-5-(p-tolyl)-2-(4-pyridyl)thieno[2,3-d]pyrimidin-3-yl]acetate CAS Name: 2-[5-(4-methylphenyl)-4-oxo-2-pyridin-4-yl-3-thieno[2,3-d]pyrimidinyl]acetate IUPAC Name: 2-[5-(4-methylphenyl)-4-oxo-2-pyridin-4-ylthieno[2,3-d]pyrimidin-3-yl]acetate Traditional Name: 2-[4-keto-5-(p-tolyl)-2-(4-pyridyl)thieno[2,3-d]pyrimidin-3-yl]acetate Formula: C20H14N3O3S- MolecularWeight: 376.40846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C4=CC=NC=C4)CC(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C4=CC=NC=C4)CC(=O)[O-]

InChI

InChI=1S/C20H15N3O3S/c1-12-2-4-13(5-3-12)15-11-27-19-17(15)20(26)23(10-16(24)25)18(22-19)14-6-8-21-9-7-14/h2-9,11H,10H2,1H3,(H,24,25)/p-1