4-(4-methyl-2-piperidin-1-yl-pyrimidin-5-yl)-2-(pyrazin-2-ylcarbonylamino)thiophene-3-carboxylic acid

Systemtic Name: 4-(4-methyl-2-piperidin-1-yl-pyrimidin-5-yl)-2-(pyrazin-2-ylcarbonylamino)thiophene-3-carboxylic acid Openeye Name: 4-[4-methyl-2-(1-piperidyl)pyrimidin-5-yl]-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid CAS Name: 4-[4-methyl-2-(1-piperidinyl)-5-pyrimidinyl]-2-[[oxo(2-pyrazinyl)methyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-(4-methyl-2-piperidin-1-ylpyrimidin-5-yl)-2-(pyrazine-2-carbonylamino)thiophene-3-carboxylic acid Traditional Name: 4-(4-methyl-2-piperidino-pyrimidin-5-yl)-2-(pyrazinoylamino)-3-thenoic acid Formula: C20H20N6O3S MolecularWeight: 424.4762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C2=CSC(=C2C(=O)O)NC(=O)C3=NC=CN=C3)N4CCCCC4

Isomeric SMILES

CC1=NC(=NC=C1C2=CSC(=C2C(=O)O)NC(=O)C3=NC=CN=C3)N4CCCCC4

InChI

InChI=1S/C20H20N6O3S/c1-12-13(9-23-20(24-12)26-7-3-2-4-8-26)14-11-30-18(16(14)19(28)29)25-17(27)15-10-21-5-6-22-15/h5-6,9-11H,2-4,7-8H2,1H3,(H,25,27)(H,28,29)