N-carbamimidoyl-N-[2-(sulfonylmethyl)phenoxy]-3-(trifluoromethyl)benzamide dihydrochloride

Systemtic Name: N-carbamimidoyl-N-[2-(sulfonylmethyl)phenoxy]-3-(trifluoromethyl)benzamide dihydrochloride Openeye Name: N-carbamimidoyl-N-[2-(sulfonylmethyl)phenoxy]-3-(trifluoromethyl)benzamide dihydrochloride CAS Name: N-carbamimidoyl-N-[2-(sulfonylmethyl)phenoxy]-3-(trifluoromethyl)benzamide dihydrochloride IUPAC Name: N-carbamimidoyl-N-[2-(sulfonylmethyl)phenoxy]-3-(trifluoromethyl)benzamide dihydrochloride Traditional Name: N-amidino-N-[2-(sulfonylmethyl)phenoxy]-3-(trifluoromethyl)benzamide dihydrochloride Formula: C16H14Cl2F3N3O4S MolecularWeight: 472.26627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=S(=O)=O)ON(C(=O)C2=CC(=CC=C2)C(F)(F)F)C(=N)N.Cl.Cl

Isomeric SMILES

C1=CC=C(C(=C1)C=S(=O)=O)ON(C(=O)C2=CC(=CC=C2)C(F)(F)F)C(=N)N.Cl.Cl

InChI

InChI=1S/C16H12F3N3O4S.2ClH/c17-16(18,19)12-6-3-5-10(8-12)14(23)22(15(20)21)26-13-7-2-1-4-11(13)9-27(24)25;;/h1-9H,(H3,20,21);2*1H