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

Systemtic Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-propan-2-yl-amino]-3-prop-2-ynoxy-propan-2-ol Openeye Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-isopropyl-amino]-3-prop-2-ynoxy-propan-2-ol CAS Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-4-pyrazolyl]methyl-propan-2-ylamino]-3-prop-2-ynoxy-2-propanol IUPAC Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenylpyrazol-4-yl]methyl-propan-2-ylamino]-3-prop-2-ynoxypropan-2-ol Traditional Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-isopropyl-amino]-3-propargyloxy-propan-2-ol Formula: C28H35N3O4 MolecularWeight: 477.5952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O4/c1-6-17-34-20-23(32)18-30(21(3)4)19-26-27(7-2)29-31(22-11-9-8-10-12-22)28(26)35-25-15-13-24(33-5)14-16-25/h1,8-16,21,23,32H,7,17-20H2,2-5H3