ethyl 2-[4-[[(1-methylindazol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[4-[[(1-methylindazol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxylate Openeye Name: ethyl 2-[4-[[(1-methylindazol-3-yl)methylamino]methyl]-1-piperidyl]pyrimidine-5-carboxylate CAS Name: 2-[4-[[(1-methyl-3-indazolyl)methylamino]methyl]-1-piperidinyl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-[[(1-methylindazol-3-yl)methylamino]methyl]piperidin-1-yl]pyrimidine-5-carboxylate Traditional Name: 2-[4-[[(1-methylindazol-3-yl)methylamino]methyl]piperidino]pyrimidine-5-carboxylic acid ethyl ester Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1)N2CCC(CC2)CNCC3=NN(C4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1)N2CCC(CC2)CNCC3=NN(C4=CC=CC=C43)C

InChI

InChI=1S/C22H28N6O2/c1-3-30-21(29)17-13-24-22(25-14-17)28-10-8-16(9-11-28)12-23-15-19-18-6-4-5-7-20(18)27(2)26-19/h4-7,13-14,16,23H,3,8-12,15H2,1-2H3