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

Systemtic Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(furan-2-ylmethyl)amino]-3-prop-2-ynoxy-propan-2-ol Openeye Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(2-furylmethyl)amino]-3-prop-2-ynoxy-propan-2-ol CAS Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-4-pyrazolyl)methyl-(2-furanylmethyl)amino]-3-prop-2-ynoxy-2-propanol IUPAC Name: 1-[(3-ethyl-5-phenoxy-1-phenylpyrazol-4-yl)methyl-(furan-2-ylmethyl)amino]-3-prop-2-ynoxypropan-2-ol Traditional Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(2-furfuryl)amino]-3-propargyloxy-propan-2-ol Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CN(CC2=CC=CO2)CC(COCC#C)O)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN(C(=C1CN(CC2=CC=CO2)CC(COCC#C)O)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O4/c1-3-17-34-22-24(33)19-31(20-26-16-11-18-35-26)21-27-28(4-2)30-32(23-12-7-5-8-13-23)29(27)36-25-14-9-6-10-15-25/h1,5-16,18,24,33H,4,17,19-22H2,2H3