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

Systemtic Name: diethyl 5-[(5-chloranyl-2-propylsulfanyl-pyrimidin-4-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[(5-chloro-2-propylsulfanyl-pyrimidine-4-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[5-chloro-2-(propylthio)-4-pyrimidinyl]-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[(5-chloro-2-propylsulfanylpyrimidine-4-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[5-chloro-2-(propylthio)pyrimidine-4-carbonyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H22ClN3O5S2 MolecularWeight: 471.97808

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(C(=N1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)OCC)Cl

Isomeric SMILES

CCCSC1=NC=C(C(=N1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C(=O)OCC)Cl

InChI

InChI=1S/C19H22ClN3O5S2/c1-5-8-29-19-21-9-11(20)13(22-19)15(24)23-16-12(17(25)27-6-2)10(4)14(30-16)18(26)28-7-3/h9H,5-8H2,1-4H3,(H,23,24)