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

Systemtic Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl-(phenylmethyl)amino]-3-prop-2-ynoxy-propan-2-ol Openeye Name: 1-[benzyl-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl]amino]-3-prop-2-ynoxy-propan-2-ol CAS Name: 1-[(3-ethyl-5-phenoxy-1-phenyl-4-pyrazolyl)methyl-(phenylmethyl)amino]-3-prop-2-ynoxy-2-propanol IUPAC Name: 1-[benzyl-[(3-ethyl-5-phenoxy-1-phenylpyrazol-4-yl)methyl]amino]-3-prop-2-ynoxypropan-2-ol Traditional Name: 1-[benzyl-[(3-ethyl-5-phenoxy-1-phenyl-pyrazol-4-yl)methyl]amino]-3-propargyloxy-propan-2-ol Formula: C31H33N3O3 MolecularWeight: 495.61202

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CN(CC2=CC=CC=C2)CC(COCC#C)O)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN(C(=C1CN(CC2=CC=CC=C2)CC(COCC#C)O)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H33N3O3/c1-3-20-36-24-27(35)22-33(21-25-14-8-5-9-15-25)23-29-30(4-2)32-34(26-16-10-6-11-17-26)31(29)37-28-18-12-7-13-19-28/h1,5-19,27,35H,4,20-24H2,2H3