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

Systemtic Name: 1-[(3-carbamimidoylphenyl)methyl]-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea Openeye Name: 1-[(3-carbamimidoylphenyl)methyl]-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea Traditional Name: 1-(3-amidinobenzyl)-1-phenyl-3-[4-(2-sulfamoylphenyl)phenyl]urea Formula: C27H25N5O3S MolecularWeight: 499.5841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC2=CC=CC(=C2)C(=N)N)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C=C1)N(CC2=CC=CC(=C2)C(=N)N)C(=O)NC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C27H25N5O3S/c28-26(29)21-8-6-7-19(17-21)18-32(23-9-2-1-3-10-23)27(33)31-22-15-13-20(14-16-22)24-11-4-5-12-25(24)36(30,34)35/h1-17H,18H2,(H3,28,29)(H,31,33)(H2,30,34,35)