(4-methylsulfanylphenyl)methyl 5-(cyclopropylsulfamoyl)-2-methyl-benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 5-(cyclopropylsulfamoyl)-2-methyl-benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 5-(cyclopropylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(cyclopropylsulfamoyl)-2-methylbenzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 5-(cyclopropylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(cyclopropylsulfamoyl)-2-methyl-benzoic acid [4-(methylthio)benzyl] ester Formula: C19H21NO4S2 MolecularWeight: 391.50434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)OCC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)OCC3=CC=C(C=C3)SC

InChI

InChI=1S/C19H21NO4S2/c1-13-3-10-17(26(22,23)20-15-6-7-15)11-18(13)19(21)24-12-14-4-8-16(25-2)9-5-14/h3-5,8-11,15,20H,6-7,12H2,1-2H3