6-[[(4R)-1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[(4R)-1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]carbamoyl]pyridazin-3-olate Openeye Name: 6-[[(4R)-1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]carbamoyl]pyridazin-3-olate CAS Name: 6-[[[(4R)-1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]amino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[(4R)-1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]carbamoyl]pyridazin-3-olate Traditional Name: 6-[[(4R)-1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazol-4-yl]carbamoyl]pyridazin-3-olate Formula: C22H24N5O2- MolecularWeight: 390.45826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)N2C3=C(C=N2)C(CCC3)NC(=O)C4=NN=C(C=C4)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)N2C3=C(C=N2)[C@@H](CCC3)NC(=O)C4=NN=C(C=C4)[O-]

InChI

InChI=1S/C22H25N5O2/c1-22(2,3)14-7-9-15(10-8-14)27-19-6-4-5-17(16(19)13-23-27)24-21(29)18-11-12-20(28)26-25-18/h7-13,17H,4-6H2,1-3H3,(H,24,29)(H,26,28)/p-1/t17-/m1/s1