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

Systemtic Name: 2-methylpropyl 2-[2-(5-ethoxycarbonyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 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 2-methylpropyl ester IUPAC Name: 2-methylpropyl 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 isobutyl ester Formula: C26H30N4O6S2 MolecularWeight: 558.6696

Click to see the large picture

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)SCCC3=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)SCCC3=CC=CC=C3

InChI

InChI=1S/C26H30N4O6S2/c1-5-35-23(33)19-13-27-26(37-12-11-18-9-7-6-8-10-18)30(22(19)32)14-20(31)29-25-28-17(4)21(38-25)24(34)36-15-16(2)3/h6-10,13,16H,5,11-12,14-15H2,1-4H3,(H,28,29,31)