1-[(3-carbamimidoylphenyl)amino]-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea

Systemtic Name: 1-[(3-carbamimidoylphenyl)amino]-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea Openeye Name: 1-(3-carbamimidoylanilino)-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea CAS Name: 1-(3-carbamimidoylanilino)-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea IUPAC Name: 1-(3-carbamimidoylanilino)-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea Traditional Name: 1-(3-amidinoanilino)-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea Formula: C26H24N6O3S MolecularWeight: 500.57216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)NC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1=CC=C(C=C1)N(C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)NC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C26H24N6O3S/c27-25(28)19-7-6-8-21(17-19)31-32(22-9-2-1-3-10-22)26(33)30-20-15-13-18(14-16-20)23-11-4-5-12-24(23)36(29,34)35/h1-17,31H,(H3,27,28)(H,30,33)(H2,29,34,35)