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

Systemtic Name: 1-[butan-2-yl-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl]amino]butan-2-ol Openeye Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-sec-butyl-amino]butan-2-ol CAS Name: 1-[butan-2-yl-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-4-pyrazolyl]methyl]amino]-2-butanol IUPAC Name: 1-[butan-2-yl-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenylpyrazol-4-yl]methyl]amino]butan-2-ol Traditional Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-sec-butyl-amino]butan-2-ol Formula: C27H37N3O3 MolecularWeight: 451.60098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H37N3O3/c1-6-20(4)29(18-22(31)7-2)19-25-26(8-3)28-30(21-12-10-9-11-13-21)27(25)33-24-16-14-23(32-5)15-17-24/h9-17,20,22,31H,6-8,18-19H2,1-5H3