3-methyl-5-[2-[methyl(pyrimidin-2-yl)amino]ethanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-methyl-5-[2-[methyl(pyrimidin-2-yl)amino]ethanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-methyl-5-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]thiophene-2-carboxylic acid CAS Name: 3-methyl-5-[[2-[methyl(2-pyrimidinyl)amino]-1-oxoethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-methyl-5-[[2-[methyl(pyrimidin-2-yl)amino]acetyl]amino]thiophene-2-carboxylic acid Traditional Name: 3-methyl-5-[[2-[methyl(2-pyrimidyl)amino]acetyl]amino]-2-thenoic acid Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=O)CN(C)C2=NC=CC=N2)C(=O)O

Isomeric SMILES

CC1=C(SC(=C1)NC(=O)CN(C)C2=NC=CC=N2)C(=O)O

InChI

InChI=1S/C13H14N4O3S/c1-8-6-10(21-11(8)12(19)20)16-9(18)7-17(2)13-14-4-3-5-15-13/h3-6H,7H2,1-2H3,(H,16,18)(H,19,20)