prop-2-enyl 2-[[4-(4-fluoranylphenoxy)phenyl]sulfonylamino]-3-methyl-3-sulfanyl-butanoate

Systemtic Name: prop-2-enyl 2-[[4-(4-fluoranylphenoxy)phenyl]sulfonylamino]-3-methyl-3-sulfanyl-butanoate Openeye Name: allyl 2-[[4-(4-fluorophenoxy)phenyl]sulfonylamino]-3-methyl-3-sulfanyl-butanoate CAS Name: 2-[[4-(4-fluorophenoxy)phenyl]sulfonylamino]-3-mercapto-3-methylbutanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[[4-(4-fluorophenoxy)phenyl]sulfonylamino]-3-methyl-3-sulfanylbutanoate Traditional Name: 2-[[4-(4-fluorophenoxy)phenyl]sulfonylamino]-3-mercapto-3-methyl-butyric acid allyl ester Formula: C20H22FNO5S2 MolecularWeight: 439.520783

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)OCC=C)NS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)F)S

Isomeric SMILES

CC(C)(C(C(=O)OCC=C)NS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)F)S

InChI

InChI=1S/C20H22FNO5S2/c1-4-13-26-19(23)18(20(2,3)28)22-29(24,25)17-11-9-16(10-12-17)27-15-7-5-14(21)6-8-15/h4-12,18,22,28H,1,13H2,2-3H3