ethyl 5-[3-[methyl-(1-methylpiperidin-4-yl)amino]propanoylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[3-[methyl-(1-methylpiperidin-4-yl)amino]propanoylamino]-1-quinolin-2-yl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[3-[methyl-(1-methyl-4-piperidyl)amino]propanoylamino]-1-(2-quinolyl)pyrazole-4-carboxylate CAS Name: 5-[[3-[methyl-(1-methyl-4-piperidinyl)amino]-1-oxopropyl]amino]-1-(2-quinolinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-[methyl-(1-methylpiperidin-4-yl)amino]propanoylamino]-1-quinolin-2-ylpyrazole-4-carboxylate Traditional Name: 5-[3-[methyl-(1-methyl-4-piperidyl)amino]propanoylamino]-1-(2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C25H32N6O3 MolecularWeight: 464.55998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)CCN(C)C4CCN(CC4)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C=C2)NC(=O)CCN(C)C4CCN(CC4)C

InChI

InChI=1S/C25H32N6O3/c1-4-34-25(33)20-17-26-31(22-10-9-18-7-5-6-8-21(18)27-22)24(20)28-23(32)13-16-30(3)19-11-14-29(2)15-12-19/h5-10,17,19H,4,11-16H2,1-3H3,(H,28,32)