2-methylpropyl 2-[2-[5-ethoxycarbonyl-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidin-1-yl]ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-methylpropyl 2-[2-[5-ethoxycarbonyl-6-oxidanylidene-2-(phenylmethylsulfanyl)pyrimidin-1-yl]ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 2-[[2-(2-benzylsulfanyl-5-ethoxycarbonyl-6-oxo-pyrimidin-1-yl)acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[5-ethoxycarbonyl-6-oxo-2-(phenylmethylthio)-1-pyrimidinyl]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[[2-(2-benzylsulfanyl-5-ethoxycarbonyl-6-oxopyrimidin-1-yl)acetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[2-(benzylthio)-5-carbethoxy-6-keto-pyrimidin-1-yl]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid isobutyl ester Formula: C25H28N4O6S2 MolecularWeight: 544.64302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=NC(=C(S2)C(=O)OCC(C)C)C)SCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=NC(=C(S2)C(=O)OCC(C)C)C)SCC3=CC=CC=C3

InChI

InChI=1S/C25H28N4O6S2/c1-5-34-22(32)18-11-26-25(36-14-17-9-7-6-8-10-17)29(21(18)31)12-19(30)28-24-27-16(4)20(37-24)23(33)35-13-15(2)3/h6-11,15H,5,12-14H2,1-4H3,(H,27,28,30)