3-[5-(3-methoxyphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoic acid

Systemtic Name: 3-[5-(3-methoxyphenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoic acid Openeye Name: 3-[5-(3-methoxyphenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoic acid CAS Name: 3-[5-(3-methoxyphenyl)-6-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid IUPAC Name: 3-[5-(3-methoxyphenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoic acid Traditional Name: 3-[4-keto-5-(3-methoxyphenyl)-6-methyl-thieno[2,3-d]pyrimidin-3-yl]propionic acid Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CCC(=O)O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CCC(=O)O)C3=CC(=CC=C3)OC

InChI

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