(5-methyl-1H-pyrazol-4-yl) 3-(1,3-oxazol-4-ylmethoxy)-3-phenyl-2-(phenylmethyl)-2-thiophen-2-yl-propanoate

Systemtic Name: (5-methyl-1H-pyrazol-4-yl) 3-(1,3-oxazol-4-ylmethoxy)-3-phenyl-2-(phenylmethyl)-2-thiophen-2-yl-propanoate Openeye Name: (5-methyl-1H-pyrazol-4-yl) 2-benzyl-3-(oxazol-4-ylmethoxy)-3-phenyl-2-(2-thienyl)propanoate CAS Name: 3-(4-oxazolylmethoxy)-3-phenyl-2-(phenylmethyl)-2-thiophen-2-ylpropanoic acid (5-methyl-1H-pyrazol-4-yl) ester IUPAC Name: (5-methyl-1H-pyrazol-4-yl) 2-benzyl-3-(1,3-oxazol-4-ylmethoxy)-3-phenyl-2-thiophen-2-ylpropanoate Traditional Name: 2-benzyl-3-(oxazol-4-ylmethoxy)-3-phenyl-2-(2-thienyl)propionic acid (5-methyl-1H-pyrazol-4-yl) ester Formula: C28H25N3O4S MolecularWeight: 499.5808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)OC(=O)C(CC2=CC=CC=C2)(C3=CC=CS3)C(C4=CC=CC=C4)OCC5=COC=N5

Isomeric SMILES

CC1=C(C=NN1)OC(=O)C(CC2=CC=CC=C2)(C3=CC=CS3)C(C4=CC=CC=C4)OCC5=COC=N5

InChI

InChI=1S/C28H25N3O4S/c1-20-24(16-30-31-20)35-27(32)28(25-13-8-14-36-25,15-21-9-4-2-5-10-21)26(22-11-6-3-7-12-22)34-18-23-17-33-19-29-23/h2-14,16-17,19,26H,15,18H2,1H3,(H,30,31)