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

Systemtic Name: 1-[butan-2-yl-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl]amino]-3-prop-2-ynoxy-propan-2-ol Openeye Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-sec-butyl-amino]-3-prop-2-ynoxy-propan-2-ol CAS Name: 1-[butan-2-yl-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-4-pyrazolyl]methyl]amino]-3-prop-2-ynoxy-2-propanol IUPAC Name: 1-[butan-2-yl-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenylpyrazol-4-yl]methyl]amino]-3-prop-2-ynoxypropan-2-ol Traditional Name: 1-[[3-ethyl-5-(4-methoxyphenoxy)-1-phenyl-pyrazol-4-yl]methyl-sec-butyl-amino]-3-propargyloxy-propan-2-ol Formula: C29H37N3O4 MolecularWeight: 491.62178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37N3O4/c1-6-18-35-21-24(33)19-31(22(4)7-2)20-27-28(8-3)30-32(23-12-10-9-11-13-23)29(27)36-26-16-14-25(34-5)15-17-26/h1,9-17,22,24,33H,7-8,18-21H2,2-5H3