(phenylmethyl) 2-[2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)butanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: (phenylmethyl) 2-[2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)butanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: benzyl 2-[2-(4,6-dimethyl-2-oxo-pyrimidin-1-yl)butanoylamino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-(4,6-dimethyl-2-oxo-1-pyrimidinyl)-1-oxobutyl]amino]-4-methyl-5-thiazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[2-(4,6-dimethyl-2-oxopyrimidin-1-yl)butanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-(2-keto-4,6-dimethyl-pyrimidin-1-yl)butanoylamino]-4-methyl-thiazole-5-carboxylic acid benzyl ester Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC2=CC=CC=C2)C)N3C(=CC(=NC3=O)C)C

Isomeric SMILES

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC2=CC=CC=C2)C)N3C(=CC(=NC3=O)C)C

InChI

InChI=1S/C22H24N4O4S/c1-5-17(26-14(3)11-13(2)23-22(26)29)19(27)25-21-24-15(4)18(31-21)20(28)30-12-16-9-7-6-8-10-16/h6-11,17H,5,12H2,1-4H3,(H,24,25,27)