methyl 2-aminocarbonyl-4-[4-(3-methylphenyl)-5-pyrimidin-4-yl-1,3-thiazol-2-yl]benzoate

Systemtic Name: methyl 2-aminocarbonyl-4-[4-(3-methylphenyl)-5-pyrimidin-4-yl-1,3-thiazol-2-yl]benzoate Openeye Name: methyl 2-carbamoyl-4-[4-(m-tolyl)-5-pyrimidin-4-yl-thiazol-2-yl]benzoate CAS Name: 2-carbamoyl-4-[4-(3-methylphenyl)-5-(4-pyrimidinyl)-2-thiazolyl]benzoic acid methyl ester IUPAC Name: methyl 2-carbamoyl-4-[4-(3-methylphenyl)-5-pyrimidin-4-yl-1,3-thiazol-2-yl]benzoate Traditional Name: 2-carbamoyl-4-[4-(m-tolyl)-5-(4-pyrimidyl)thiazol-2-yl]benzoic acid methyl ester Formula: C23H18N4O3S MolecularWeight: 430.47902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=C(SC(=N2)C3=CC(=C(C=C3)C(=O)OC)C(=O)N)C4=NC=NC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=C(SC(=N2)C3=CC(=C(C=C3)C(=O)OC)C(=O)N)C4=NC=NC=C4

InChI

InChI=1S/C23H18N4O3S/c1-13-4-3-5-14(10-13)19-20(18-8-9-25-12-26-18)31-22(27-19)15-6-7-16(23(29)30-2)17(11-15)21(24)28/h3-12H,1-2H3,(H2,24,28)