4-[[[1-methyl-5-(2-pyridin-4-yl-1H-indol-5-yl)pyrazol-3-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[1-methyl-5-(2-pyridin-4-yl-1H-indol-5-yl)pyrazol-3-yl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[1-methyl-5-[2-(4-pyridyl)-1H-indol-5-yl]pyrazole-3-carbonyl]amino]methyl]benzoic acid CAS Name: 4-[[[[1-methyl-5-(2-pyridin-4-yl-1H-indol-5-yl)-3-pyrazolyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[1-methyl-5-(2-pyridin-4-yl-1H-indol-5-yl)pyrazole-3-carbonyl]amino]methyl]benzoic acid Traditional Name: 4-[[[1-methyl-5-[2-(4-pyridyl)-1H-indol-5-yl]pyrazole-3-carbonyl]amino]methyl]benzoic acid Formula: C26H21N5O3 MolecularWeight: 451.47664

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(=O)NCC2=CC=C(C=C2)C(=O)O)C3=CC4=C(C=C3)NC(=C4)C5=CC=NC=C5

Isomeric SMILES

CN1C(=CC(=N1)C(=O)NCC2=CC=C(C=C2)C(=O)O)C3=CC4=C(C=C3)NC(=C4)C5=CC=NC=C5

InChI

InChI=1S/C26H21N5O3/c1-31-24(14-23(30-31)25(32)28-15-16-2-4-18(5-3-16)26(33)34)19-6-7-21-20(12-19)13-22(29-21)17-8-10-27-11-9-17/h2-14,29H,15H2,1H3,(H,28,32)(H,33,34)