2-[6-ethyl-2-(3-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoic acid

Systemtic Name: 2-[6-ethyl-2-(3-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanoic acid Openeye Name: 2-[6-ethyl-2-(m-tolyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetic acid CAS Name: 2-[6-ethyl-2-(3-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetic acid IUPAC Name: 2-[6-ethyl-2-(3-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetic acid Traditional Name: 2-[6-ethyl-4-keto-2-(m-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetic acid Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CC(=O)O)C3=CC(=CC=C3)C

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CC(=O)O)C3=CC(=CC=C3)C

InChI

InChI=1S/C17H16N2O3S/c1-3-12-8-13-16(23-12)18-15(11-6-4-5-10(2)7-11)19(17(13)22)9-14(20)21/h4-8H,3,9H2,1-2H3,(H,20,21)