methyl 4-[4-methyl-5-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate

Systemtic Name: methyl 4-[4-methyl-5-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Openeye Name: methyl 4-[4-methyl-5-[(5-methylisoxazol-3-yl)carbamoyl]-3-phenyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoate CAS Name: 4-[4-methyl-5-[[(5-methyl-3-isoxazolyl)amino]-oxomethyl]-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-methyl-5-[(5-methyl-1,2-oxazol-3-yl)carbamoyl]-3-phenyl-2-sulfanylidene-1,6-dihydropyrimidin-6-yl]benzoate Traditional Name: 4-[4-methyl-5-[(5-methylisoxazol-3-yl)carbamoyl]-3-phenyl-2-thioxo-1,6-dihydropyrimidin-6-yl]benzoic acid methyl ester Formula: C24H22N4O4S MolecularWeight: 462.52088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C2=C(N(C(=S)NC2C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C2=C(N(C(=S)NC2C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)C

InChI

InChI=1S/C24H22N4O4S/c1-14-13-19(27-32-14)25-22(29)20-15(2)28(18-7-5-4-6-8-18)24(33)26-21(20)16-9-11-17(12-10-16)23(30)31-3/h4-13,21H,1-3H3,(H,26,33)(H,25,27,29)