6-[4-[[(2R)-2-(1H-indol-3-yl)-2-phenyl-ethyl]carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate

Systemtic Name: 6-[4-[[(2R)-2-(1H-indol-3-yl)-2-phenyl-ethyl]carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate Openeye Name: 6-[4-[[(2R)-2-(1H-indol-3-yl)-2-phenyl-ethyl]carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate CAS Name: 6-[4-[[[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]amino]-oxomethyl]-5-methyl-1-pyrazolyl]-3-pyridazinolate IUPAC Name: 6-[4-[[(2R)-2-(1H-indol-3-yl)-2-phenylethyl]carbamoyl]-5-methylpyrazol-1-yl]pyridazin-3-olate Traditional Name: 6-[4-[[(2R)-2-(1H-indol-3-yl)-2-phenyl-ethyl]carbamoyl]-5-methyl-pyrazol-1-yl]pyridazin-3-olate Formula: C25H21N6O2- MolecularWeight: 437.47324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NN=C(C=C2)[O-])C(=O)NCC(C3=CC=CC=C3)C4=CNC5=CC=CC=C54

Isomeric SMILES

CC1=C(C=NN1C2=NN=C(C=C2)[O-])C(=O)NC[C@H](C3=CC=CC=C3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H22N6O2/c1-16-19(15-28-31(16)23-11-12-24(32)30-29-23)25(33)27-13-20(17-7-3-2-4-8-17)21-14-26-22-10-6-5-9-18(21)22/h2-12,14-15,20,26H,13H2,1H3,(H,27,33)(H,30,32)/p-1/t20-/m1/s1