1-[(3-carbamimidoylphenyl)amino]-1-methyl-3-(3-phenyl-2-sulfamoyl-phenyl)urea

Systemtic Name: 1-[(3-carbamimidoylphenyl)amino]-1-methyl-3-(3-phenyl-2-sulfamoyl-phenyl)urea Openeye Name: 1-(3-carbamimidoylanilino)-1-methyl-3-(3-phenyl-2-sulfamoyl-phenyl)urea CAS Name: 1-(3-carbamimidoylanilino)-1-methyl-3-(3-phenyl-2-sulfamoylphenyl)urea IUPAC Name: 1-(3-carbamimidoylanilino)-1-methyl-3-(3-phenyl-2-sulfamoylphenyl)urea Traditional Name: 1-(3-amidinoanilino)-1-methyl-3-(3-phenyl-2-sulfamoyl-phenyl)urea Formula: C21H22N6O3S MolecularWeight: 438.50278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)NC1=CC=CC(=C1S(=O)(=O)N)C2=CC=CC=C2)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CN(C(=O)NC1=CC=CC(=C1S(=O)(=O)N)C2=CC=CC=C2)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C21H22N6O3S/c1-27(26-16-10-5-9-15(13-16)20(22)23)21(28)25-18-12-6-11-17(19(18)31(24,29)30)14-7-3-2-4-8-14/h2-13,26H,1H3,(H3,22,23)(H,25,28)(H2,24,29,30)