ethyl 2-[[4-[(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)carbonylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: ethyl 2-[[4-[(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)carbonylamino]piperidin-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: ethyl 2-[[4-[(2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carbonyl)amino]piperidine-4-carbonyl]amino]-3-phenyl-propanoate CAS Name: 2-[[[4-[[(2,7-dimethyl-6-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]-4-piperidinyl]-oxomethyl]amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl 2-[[4-[(2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carbonyl)amino]piperidine-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 2-[[4-[(2,7-dimethylpyrazolo[1,5-a]pyrimidine-6-carbonyl)amino]isonipecotoyl]amino]-3-phenyl-propionic acid ethyl ester Formula: C26H32N6O4 MolecularWeight: 492.57008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2(CCNCC2)NC(=O)C3=C(N4C(=CC(=N4)C)N=C3)C

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C2(CCNCC2)NC(=O)C3=C(N4C(=CC(=N4)C)N=C3)C

InChI

InChI=1S/C26H32N6O4/c1-4-36-24(34)21(15-19-8-6-5-7-9-19)29-25(35)26(10-12-27-13-11-26)30-23(33)20-16-28-22-14-17(2)31-32(22)18(20)3/h5-9,14,16,21,27H,4,10-13,15H2,1-3H3,(H,29,35)(H,30,33)