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

Systemtic Name: prop-2-enyl 2-[2-(5-ethoxycarbonyl-6-oxidanylidene-2-phenethylsulfanyl-pyrimidin-1-yl)ethanoylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: allyl 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 prop-2-enyl ester IUPAC Name: prop-2-enyl 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 allyl ester Formula: C25H26N4O6S2 MolecularWeight: 542.62714

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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)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)SCCC3=CC=CC=C3

InChI

InChI=1S/C25H26N4O6S2/c1-4-12-35-23(33)20-16(3)27-24(37-20)28-19(30)15-29-21(31)18(22(32)34-5-2)14-26-25(29)36-13-11-17-9-7-6-8-10-17/h4,6-10,14H,1,5,11-13,15H2,2-3H3,(H,27,28,30)