2-methylpropyl 2-[(5-chloranyl-2-prop-2-enylsulfanyl-pyrimidin-4-yl)carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: 2-methylpropyl 2-[(5-chloranyl-2-prop-2-enylsulfanyl-pyrimidin-4-yl)carbonylamino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: isobutyl 2-[(2-allylsulfanyl-5-chloro-pyrimidine-4-carbonyl)amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[[5-chloro-2-(prop-2-enylthio)-4-pyrimidinyl]-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[(5-chloro-2-prop-2-enylsulfanylpyrimidine-4-carbonyl)amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[2-(allylthio)-5-chloro-pyrimidine-4-carbonyl]amino]-4-methyl-thiazole-5-carboxylic acid isobutyl ester Formula: C17H19ClN4O3S2 MolecularWeight: 426.94076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=NC(=NC=C2Cl)SCC=C)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=NC(=NC=C2Cl)SCC=C)C(=O)OCC(C)C

InChI

InChI=1S/C17H19ClN4O3S2/c1-5-6-26-16-19-7-11(18)12(21-16)14(23)22-17-20-10(4)13(27-17)15(24)25-8-9(2)3/h5,7,9H,1,6,8H2,2-4H3,(H,20,22,23)