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

Systemtic Name: propan-2-yl 2-[2-(5-ethoxycarbonyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isopropyl 2-[[2-(5-ethoxycarbonyl-6-oxo-2-phenethylsulfanyl-pyrimidin-1-yl)acetyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-[5-ethoxycarbonyl-6-oxo-2-(phenethylthio)-1-pyrimidinyl]-1-oxoethyl]amino]-4-methyl-5-thiazolecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-(5-ethoxycarbonyl-6-oxo-2-phenethylsulfanylpyrimidin-1-yl)acetyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-[5-carbethoxy-6-keto-2-(phenethylthio)pyrimidin-1-yl]acetyl]amino]-4-methyl-thiazole-5-carboxylic acid isopropyl 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)OC(C)C)C)SCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CN=C(N(C1=O)CC(=O)NC2=NC(=C(S2)C(=O)OC(C)C)C)SCCC3=CC=CC=C3

InChI

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