[2-[[2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] thiophene-3-carboxylate

Systemtic Name: [2-[[2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl] thiophene-3-carboxylate Openeye Name: [2-[[2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]-2-oxo-ethyl] thiophene-3-carboxylate CAS Name: 3-thiophenecarboxylic acid [2-[[2-(4,6-dimethyl-2-pyrimidinyl)-5-methyl-3-pyrazolyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[2-(4,6-dimethylpyrimidin-2-yl)-5-methylpyrazol-3-yl]amino]-2-oxoethyl] thiophene-3-carboxylate Traditional Name: thiophene-3-carboxylic acid [2-[[2-(4,6-dimethylpyrimidin-2-yl)-5-methyl-pyrazol-3-yl]amino]-2-keto-ethyl] ester Formula: C17H17N5O3S MolecularWeight: 371.41358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C(=CC(=N2)C)NC(=O)COC(=O)C3=CSC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C(=CC(=N2)C)NC(=O)COC(=O)C3=CSC=C3)C

InChI

InChI=1S/C17H17N5O3S/c1-10-6-11(2)19-17(18-10)22-14(7-12(3)21-22)20-15(23)8-25-16(24)13-4-5-26-9-13/h4-7,9H,8H2,1-3H3,(H,20,23)