1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(2-methylpropyl)amino]butan-2-ol

Systemtic Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(2-methylpropyl)amino]butan-2-ol Openeye Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-isobutyl-amino]butan-2-ol CAS Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-4-pyrazolyl)methyl-(2-methylpropyl)amino]-2-butanol IUPAC Name: 1-[(3-ethyl-5-phenoxy-1-phenylpyrazol-4-yl)methyl-(2-methylpropyl)amino]butan-2-ol Traditional Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-isobutyl-amino]butan-2-ol Formula: C26H35N3O2 MolecularWeight: 421.575

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CN(CC(C)C)CC(CC)O)OC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCC1=NN(C(=C1CN(CC(C)C)CC(CC)O)OC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H35N3O2/c1-5-22(30)18-28(17-20(3)4)19-24-25(6-2)27-29(21-13-9-7-10-14-21)26(24)31-23-15-11-8-12-16-23/h7-16,20,22,30H,5-6,17-19H2,1-4H3