ethyl 2-[[5-ethoxycarbonyl-4-[(4-methylphenyl)sulfanylmethyl]pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[5-ethoxycarbonyl-4-[(4-methylphenyl)sulfanylmethyl]pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[5-ethoxycarbonyl-4-(p-tolylsulfanylmethyl)pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[5-ethoxycarbonyl-4-[[(4-methylphenyl)thio]methyl]-2-pyrimidinyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-ethoxycarbonyl-4-[(4-methylphenyl)sulfanylmethyl]pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[5-carbethoxy-4-[(p-tolylthio)methyl]pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C22H24N4O4S2 MolecularWeight: 472.58036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1CSC2=CC=C(C=C2)C)NC3=NC(=C(S3)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1CSC2=CC=C(C=C2)C)NC3=NC(=C(S3)C(=O)OCC)C

InChI

InChI=1S/C22H24N4O4S2/c1-5-29-19(27)16-11-23-21(25-17(16)12-31-15-9-7-13(3)8-10-15)26-22-24-14(4)18(32-22)20(28)30-6-2/h7-11H,5-6,12H2,1-4H3,(H,23,24,25,26)