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

Systemtic Name: 1-[(3-carbamimidoylphenyl)amino]-1-(2-methoxyethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea Openeye Name: 1-(3-carbamimidoylanilino)-1-(2-methoxyethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea CAS Name: 1-(3-carbamimidoylanilino)-1-(2-methoxyethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea IUPAC Name: 1-(3-carbamimidoylanilino)-1-(2-methoxyethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea Traditional Name: 1-(3-amidinoanilino)-1-(2-methoxyethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea Formula: C23H26N6O4S MolecularWeight: 482.55534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N6O4S/c1-33-14-13-29(28-19-6-4-5-17(15-19)22(24)25)23(30)27-18-11-9-16(10-12-18)20-7-2-3-8-21(20)34(26,31)32/h2-12,15,28H,13-14H2,1H3,(H3,24,25)(H,27,30)(H2,26,31,32)