(1R)-1-[[5-[(2-cyanopyridin-4-yl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidin-7-yl]carbonylamino]-2,3-dihydro-1H-indene-5-carboxylic acid

Systemtic Name: (1R)-1-[[5-[(2-cyanopyridin-4-yl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidin-7-yl]carbonylamino]-2,3-dihydro-1H-indene-5-carboxylic acid Openeye Name: (1R)-1-[[5-[(2-cyano-4-pyridyl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidine-7-carbonyl]amino]indane-5-carboxylic acid CAS Name: (1R)-1-[[[5-[[(2-cyano-4-pyridinyl)methylamino]-oxomethyl]-7-pyrazolo[1,5-a]pyrimidinyl]-oxomethyl]amino]-2,3-dihydro-1H-indene-5-carboxylic acid IUPAC Name: (1R)-1-[[5-[(2-cyanopyridin-4-yl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidine-7-carbonyl]amino]-2,3-dihydro-1H-indene-5-carboxylic acid Traditional Name: (1R)-1-[[5-[(2-cyano-4-pyridyl)methylcarbamoyl]pyrazolo[1,5-a]pyrimidine-7-carbonyl]amino]indane-5-carboxylic acid Formula: C25H19N7O4 MolecularWeight: 481.46286

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1NC(=O)C3=CC(=NC4=CC=NN43)C(=O)NCC5=CC(=NC=C5)C#N)C=CC(=C2)C(=O)O

Isomeric SMILES

C1CC2=C([C@@H]1NC(=O)C3=CC(=NC4=CC=NN43)C(=O)NCC5=CC(=NC=C5)C#N)C=CC(=C2)C(=O)O

InChI

InChI=1S/C25H19N7O4/c26-12-17-9-14(5-7-27-17)13-28-23(33)20-11-21(32-22(30-20)6-8-29-32)24(34)31-19-4-2-15-10-16(25(35)36)1-3-18(15)19/h1,3,5-11,19H,2,4,13H2,(H,28,33)(H,31,34)(H,35,36)/t19-/m1/s1