2-[(3-carbamimidoylphenyl)amino]-2-methyl-N-[4-(2-sulfamoylphenyl)phenyl]propanamide

Systemtic Name: 2-[(3-carbamimidoylphenyl)amino]-2-methyl-N-[4-(2-sulfamoylphenyl)phenyl]propanamide Openeye Name: 2-(3-carbamimidoylanilino)-2-methyl-N-[4-(2-sulfamoylphenyl)phenyl]propanamide CAS Name: 2-(3-carbamimidoylanilino)-2-methyl-N-[4-(2-sulfamoylphenyl)phenyl]propanamide IUPAC Name: 2-(3-carbamimidoylanilino)-2-methyl-N-[4-(2-sulfamoylphenyl)phenyl]propanamide Traditional Name: 2-(3-amidinoanilino)-2-methyl-N-[4-(2-sulfamoylphenyl)phenyl]propionamide Formula: C23H25N5O3S MolecularWeight: 451.5413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC(C)(C(=O)NC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C23H25N5O3S/c1-23(2,28-18-7-5-6-16(14-18)21(24)25)22(29)27-17-12-10-15(11-13-17)19-8-3-4-9-20(19)32(26,30)31/h3-14,28H,1-2H3,(H3,24,25)(H,27,29)(H2,26,30,31)