O4-ethyl O2-methyl 5-[(5-chloranyl-2-prop-2-enylsulfanyl-pyrimidin-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 5-[(5-chloranyl-2-prop-2-enylsulfanyl-pyrimidin-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 5-[(2-allylsulfanyl-5-chloro-pyrimidine-4-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[5-chloro-2-(prop-2-enylthio)-4-pyrimidinyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 5-[(5-chloro-2-prop-2-enylsulfanylpyrimidine-4-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(allylthio)-5-chloro-pyrimidine-4-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester Formula: C18H18ClN3O5S2 MolecularWeight: 455.93562

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=NC(=NC=C2Cl)SCC=C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=NC(=NC=C2Cl)SCC=C

InChI

InChI=1S/C18H18ClN3O5S2/c1-5-7-28-18-20-8-10(19)12(21-18)14(23)22-15-11(16(24)27-6-2)9(3)13(29-15)17(25)26-4/h5,8H,1,6-7H2,2-4H3,(H,22,23)