1-[[5-[2,4-bis(fluoranyl)phenoxy]-1-methyl-3-phenyl-pyrazol-4-yl]methyl-cyclopropyl-amino]-3-prop-2-ynoxy-propan-2-ol

Systemtic Name: 1-[[5-[2,4-bis(fluoranyl)phenoxy]-1-methyl-3-phenyl-pyrazol-4-yl]methyl-cyclopropyl-amino]-3-prop-2-ynoxy-propan-2-ol Openeye Name: 1-[cyclopropyl-[[5-(2,4-difluorophenoxy)-1-methyl-3-phenyl-pyrazol-4-yl]methyl]amino]-3-prop-2-ynoxy-propan-2-ol CAS Name: 1-[cyclopropyl-[[5-(2,4-difluorophenoxy)-1-methyl-3-phenyl-4-pyrazolyl]methyl]amino]-3-prop-2-ynoxy-2-propanol IUPAC Name: 1-[cyclopropyl-[[5-(2,4-difluorophenoxy)-1-methyl-3-phenylpyrazol-4-yl]methyl]amino]-3-prop-2-ynoxypropan-2-ol Traditional Name: 1-[cyclopropyl-[[5-(2,4-difluorophenoxy)-1-methyl-3-phenyl-pyrazol-4-yl]methyl]amino]-3-propargyloxy-propan-2-ol Formula: C26H27F2N3O3 MolecularWeight: 467.507686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC=CC=C2)CN(CC(COCC#C)O)C3CC3)OC4=C(C=C(C=C4)F)F

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC=CC=C2)CN(CC(COCC#C)O)C3CC3)OC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C26H27F2N3O3/c1-3-13-33-17-21(32)15-31(20-10-11-20)16-22-25(18-7-5-4-6-8-18)29-30(2)26(22)34-24-12-9-19(27)14-23(24)28/h1,4-9,12,14,20-21,32H,10-11,13,15-17H2,2H3