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

Systemtic Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(2-methylpropyl)amino]-2-methyl-but-3-en-2-ol Openeye Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-isobutyl-amino]-2-methyl-but-3-en-2-ol CAS Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-4-pyrazolyl)methyl-(2-methylpropyl)amino]-2-methyl-3-buten-2-ol IUPAC Name: 1-[(3-ethyl-5-phenoxy-1-phenylpyrazol-4-yl)methyl-(2-methylpropyl)amino]-2-methylbut-3-en-2-ol Traditional Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-isobutyl-amino]-2-methyl-but-3-en-2-ol Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H35N3O2/c1-6-25-24(19-29(18-21(3)4)20-27(5,31)7-2)26(32-23-16-12-9-13-17-23)30(28-25)22-14-10-8-11-15-22/h7-17,21,31H,2,6,18-20H2,1,3-5H3