diethyl 5-[(5-chloranyl-2-ethylsulfanyl-pyrimidin-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[(5-chloranyl-2-ethylsulfanyl-pyrimidin-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[(5-chloro-2-ethylsulfanyl-pyrimidine-4-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[5-chloro-2-(ethylthio)-4-pyrimidinyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(5-chloro-2-ethylsulfanylpyrimidine-4-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[5-chloro-2-(ethylthio)pyrimidine-4-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H20ClN3O5S2 MolecularWeight: 457.9515

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClN3O5S2/c1-5-26-16(24)11-9(4)13(17(25)27-6-2)29-15(11)22-14(23)12-10(19)8-20-18(21-12)28-7-3/h8H,5-7H2,1-4H3,(H,22,23)