methyl 4-azanyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrimidine-5-carboxylate

Systemtic Name: methyl 4-azanyl-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrimidine-5-carboxylate Openeye Name: methyl 4-amino-2-[(5-piperazin-1-yl-2-pyridyl)amino]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[5-(1-piperazinyl)-2-pyridinyl]amino]-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-2-[(5-piperazin-1-ylpyridin-2-yl)amino]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(5-piperazino-2-pyridyl)amino]pyrimidine-5-carboxylic acid methyl ester Formula: C15H19N7O2 MolecularWeight: 329.35706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(N=C1N)NC2=NC=C(C=C2)N3CCNCC3

Isomeric SMILES

COC(=O)C1=CN=C(N=C1N)NC2=NC=C(C=C2)N3CCNCC3

InChI

InChI=1S/C15H19N7O2/c1-24-14(23)11-9-19-15(21-13(11)16)20-12-3-2-10(8-18-12)22-6-4-17-5-7-22/h2-3,8-9,17H,4-7H2,1H3,(H3,16,18,19,20,21)