4-[[3-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfonyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[[3-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfonyl]-1,2-dihydropyrazol-3-one Openeye Name: 4-[[3-[2-(2-phenyloxazol-4-yl)ethoxy]phenyl]methylsulfonyl]-1,2-dihydropyrazol-3-one CAS Name: 4-[[3-[2-(2-phenyl-4-oxazolyl)ethoxy]phenyl]methylsulfonyl]-1,2-dihydropyrazol-3-one IUPAC Name: 4-[[3-[2-(2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfonyl]-1,2-dihydropyrazol-3-one Traditional Name: 4-[3-[2-(2-phenyloxazol-4-yl)ethoxy]benzyl]sulfonyl-3-pyrazolin-3-one Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CO2)CCOC3=CC=CC(=C3)CS(=O)(=O)C4=CNNC4=O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CO2)CCOC3=CC=CC(=C3)CS(=O)(=O)C4=CNNC4=O

InChI

InChI=1S/C21H19N3O5S/c25-20-19(12-22-24-20)30(26,27)14-15-5-4-8-18(11-15)28-10-9-17-13-29-21(23-17)16-6-2-1-3-7-16/h1-8,11-13H,9-10,14H2,(H2,22,24,25)