1-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl-propan-2-yl-amino]hex-5-en-2-ol

Systemtic Name: 1-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl-propan-2-yl-amino]hex-5-en-2-ol Openeye Name: 1-[isopropyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl]amino]hex-5-en-2-ol CAS Name: 1-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-4-pyrazolyl]methyl-propan-2-ylamino]-5-hexen-2-ol IUPAC Name: 1-[[1-methyl-5-(4-methylphenoxy)-3-phenylpyrazol-4-yl]methyl-propan-2-ylamino]hex-5-en-2-ol Traditional Name: 1-[isopropyl-[[1-methyl-5-(4-methylphenoxy)-3-phenyl-pyrazol-4-yl]methyl]amino]hex-5-en-2-ol Formula: C27H35N3O2 MolecularWeight: 433.5857

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=C(C(=NN2C)C3=CC=CC=C3)CN(CC(CCC=C)O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)OC2=C(C(=NN2C)C3=CC=CC=C3)CN(CC(CCC=C)O)C(C)C

InChI

InChI=1S/C27H35N3O2/c1-6-7-13-23(31)18-30(20(2)3)19-25-26(22-11-9-8-10-12-22)28-29(5)27(25)32-24-16-14-21(4)15-17-24/h6,8-12,14-17,20,23,31H,1,7,13,18-19H2,2-5H3