3-[5-(4-methoxy-3-methyl-phenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: 3-[5-(4-methoxy-3-methyl-phenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: 3-[5-(4-methoxy-3-methyl-phenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-[5-(4-methoxy-3-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: 3-[5-(4-methoxy-3-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 3-[4-keto-5-(4-methoxy-3-methyl-phenyl)thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C17H15N2O4S- MolecularWeight: 343.377

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O4S/c1-10-7-11(3-4-13(10)23-2)12-8-24-16-15(12)17(22)19(9-18-16)6-5-14(20)21/h3-4,7-9H,5-6H2,1-2H3,(H,20,21)/p-1