N-carbamimidoyl-N-[4-(propylsulfamoyl)phenoxy]-3-(trifluoromethyl)benzamide; N-methylmethanamine

Systemtic Name: N-carbamimidoyl-N-[4-(propylsulfamoyl)phenoxy]-3-(trifluoromethyl)benzamide; N-methylmethanamine Openeye Name: N-carbamimidoyl-N-[4-(propylsulfamoyl)phenoxy]-3-(trifluoromethyl)benzamide; N-methylmethanamine CAS Name: N-carbamimidoyl-N-[4-(propylsulfamoyl)phenoxy]-3-(trifluoromethyl)benzamide; N-methylmethanamine IUPAC Name: N-carbamimidoyl-N-[4-(propylsulfamoyl)phenoxy]-3-(trifluoromethyl)benzamide; N-methylmethanamine Traditional Name: N-amidino-N-[4-(propylsulfamoyl)phenoxy]-3-(trifluoromethyl)benzamide; dimethylamine Formula: C20H26F3N5O4S MolecularWeight: 489.51175

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=C(C=C1)ON(C(=O)C2=CC(=CC=C2)C(F)(F)F)C(=N)N.CNC

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=C(C=C1)ON(C(=O)C2=CC(=CC=C2)C(F)(F)F)C(=N)N.CNC

InChI

InChI=1S/C18H19F3N4O4S.C2H7N/c1-2-10-24-30(27,28)15-8-6-14(7-9-15)29-25(17(22)23)16(26)12-4-3-5-13(11-12)18(19,20)21;1-3-2/h3-9,11,24H,2,10H2,1H3,(H3,22,23);3H,1-2H3