N-carbamimidoyl-3-methylsulfonyl-N-phenoxy-benzamide dihydrochloride

Systemtic Name: N-carbamimidoyl-3-methylsulfonyl-N-phenoxy-benzamide dihydrochloride Openeye Name: N-carbamimidoyl-3-methylsulfonyl-N-phenoxy-benzamide dihydrochloride CAS Name: N-carbamimidoyl-3-methylsulfonyl-N-phenoxybenzamide dihydrochloride IUPAC Name: N-carbamimidoyl-3-methylsulfonyl-N-phenoxybenzamide dihydrochloride Traditional Name: N-amidino-3-mesyl-N-phenoxy-benzamide dihydrochloride Formula: C15H17Cl2N3O4S MolecularWeight: 406.28418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N(C(=N)N)OC2=CC=CC=C2.Cl.Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N(C(=N)N)OC2=CC=CC=C2.Cl.Cl

InChI

InChI=1S/C15H15N3O4S.2ClH/c1-23(20,21)13-9-5-6-11(10-13)14(19)18(15(16)17)22-12-7-3-2-4-8-12;;/h2-10H,1H3,(H3,16,17);2*1H