1-[[(2S)-1-methylpiperidin-2-yl]-phenyl-methyl]-3-(3-pyridin-2-yl-1H-indazol-5-yl)urea

Systemtic Name: 1-[[(2S)-1-methylpiperidin-2-yl]-phenyl-methyl]-3-(3-pyridin-2-yl-1H-indazol-5-yl)urea Openeye Name: 1-[[(2S)-1-methyl-2-piperidyl]-phenyl-methyl]-3-[3-(2-pyridyl)-1H-indazol-5-yl]urea CAS Name: 1-[[(2S)-1-methyl-2-piperidinyl]-phenylmethyl]-3-[3-(2-pyridinyl)-1H-indazol-5-yl]urea IUPAC Name: 1-[[(2S)-1-methylpiperidin-2-yl]-phenylmethyl]-3-(3-pyridin-2-yl-1H-indazol-5-yl)urea Traditional Name: 1-[[(2S)-1-methyl-2-piperidyl]-phenyl-methyl]-3-[3-(2-pyridyl)-1H-indazol-5-yl]urea Formula: C26H28N6O MolecularWeight: 440.54012

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC1C(C2=CC=CC=C2)NC(=O)NC3=CC4=C(C=C3)NN=C4C5=CC=CC=N5

Isomeric SMILES

CN1CCCC[C@H]1C(C2=CC=CC=C2)NC(=O)NC3=CC4=C(C=C3)NN=C4C5=CC=CC=N5

InChI

InChI=1S/C26H28N6O/c1-32-16-8-6-12-23(32)24(18-9-3-2-4-10-18)29-26(33)28-19-13-14-21-20(17-19)25(31-30-21)22-11-5-7-15-27-22/h2-5,7,9-11,13-15,17,23-24H,6,8,12,16H2,1H3,(H,30,31)(H2,28,29,33)/t23-,24?/m0/s1