(4-methylsulfanylphenyl)methyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 3-(cyclopropylsulfamoyl)-4-methoxy-benzoate CAS Name: 3-(cyclopropylsulfamoyl)-4-methoxybenzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 3-(cyclopropylsulfamoyl)-4-methoxybenzoate Traditional Name: 3-(cyclopropylsulfamoyl)-4-methoxy-benzoic acid [4-(methylthio)benzyl] ester Formula: C19H21NO5S2 MolecularWeight: 407.50374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)SC)S(=O)(=O)NC3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=CC=C(C=C2)SC)S(=O)(=O)NC3CC3

InChI

InChI=1S/C19H21NO5S2/c1-24-17-10-5-14(11-18(17)27(22,23)20-15-6-7-15)19(21)25-12-13-3-8-16(26-2)9-4-13/h3-5,8-11,15,20H,6-7,12H2,1-2H3