3-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(4-sulfamoylphenyl)propanamide

Systemtic Name: 3-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(4-sulfamoylphenyl)propanamide Openeye Name: 3-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(4-sulfamoylphenyl)propanamide CAS Name: 3-[methyl-[[4-(methylthio)phenyl]methyl]amino]-N-(4-sulfamoylphenyl)propanamide IUPAC Name: 3-[methyl-[(4-methylsulfanylphenyl)methyl]amino]-N-(4-sulfamoylphenyl)propanamide Traditional Name: 3-[methyl-[4-(methylthio)benzyl]amino]-N-(4-sulfamoylphenyl)propionamide Formula: C18H23N3O3S2 MolecularWeight: 393.52352

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N)CC2=CC=C(C=C2)SC

Isomeric SMILES

CN(CCC(=O)NC1=CC=C(C=C1)S(=O)(=O)N)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H23N3O3S2/c1-21(13-14-3-7-16(25-2)8-4-14)12-11-18(22)20-15-5-9-17(10-6-15)26(19,23)24/h3-10H,11-13H2,1-2H3,(H,20,22)(H2,19,23,24)