4-(3-aminophenyl)-2-ethyl-2-methyl-5-(4-methylperoxysulfanylphenyl)furan-3-one

Systemtic Name: 4-(3-aminophenyl)-2-ethyl-2-methyl-5-(4-methylperoxysulfanylphenyl)furan-3-one Openeye Name: 4-(3-aminophenyl)-2-ethyl-2-methyl-5-(4-methylperoxysulfanylphenyl)furan-3-one CAS Name: 4-[3-(3-aminophenyl)-5-ethyl-5-methyl-4-oxo-2-furanyl]benzenesulfenic acid methoxy ester IUPAC Name: 4-(3-aminophenyl)-2-ethyl-2-methyl-5-(4-methylperoxysulfanylphenyl)furan-3-one Traditional Name: 4-(3-aminophenyl)-2-ethyl-2-methyl-5-[4-(methylperoxythio)phenyl]furan-3-one Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)SOOC)C3=CC(=CC=C3)N)C

Isomeric SMILES

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)SOOC)C3=CC(=CC=C3)N)C

InChI

InChI=1S/C20H21NO4S/c1-4-20(2)19(22)17(14-6-5-7-15(21)12-14)18(24-20)13-8-10-16(11-9-13)26-25-23-3/h5-12H,4,21H2,1-3H3