4-[2-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-6-methyl-pyrimidin-4-yl]benzoic acid

Systemtic Name: 4-[2-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-6-methyl-pyrimidin-4-yl]benzoic acid Openeye Name: 4-[2-[(5-ethoxycarbonyl-4-methyl-thiazol-2-yl)amino]-6-methyl-pyrimidin-4-yl]benzoic acid CAS Name: 4-[2-[(5-ethoxycarbonyl-4-methyl-2-thiazolyl)amino]-6-methyl-4-pyrimidinyl]benzoic acid IUPAC Name: 4-[2-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-6-methylpyrimidin-4-yl]benzoic acid Traditional Name: 4-[2-[(5-carbethoxy-4-methyl-thiazol-2-yl)amino]-6-methyl-pyrimidin-4-yl]benzoic acid Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=NC(=CC(=N2)C)C3=CC=C(C=C3)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=NC(=CC(=N2)C)C3=CC=C(C=C3)C(=O)O)C

InChI

InChI=1S/C19H18N4O4S/c1-4-27-17(26)15-11(3)21-19(28-15)23-18-20-10(2)9-14(22-18)12-5-7-13(8-6-12)16(24)25/h5-9H,4H2,1-3H3,(H,24,25)(H,20,21,22,23)