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

Systemtic Name: 3-(6-methyl-4-oxidanylidene-5-phenyl-2-propan-2-yl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid Openeye Name: 3-(2-isopropyl-6-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoic acid CAS Name: 3-(6-methyl-4-oxo-5-phenyl-2-propan-2-yl-3-thieno[2,3-d]pyrimidinyl)propanoic acid IUPAC Name: 3-(6-methyl-4-oxo-5-phenyl-2-propan-2-ylthieno[2,3-d]pyrimidin-3-yl)propanoic acid Traditional Name: 3-(2-isopropyl-4-keto-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3S/c1-11(2)17-20-18-16(19(24)21(17)10-9-14(22)23)15(12(3)25-18)13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,22,23)