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

Systemtic Name: 1-[(3-carbamimidoylphenyl)amino]-1-propan-2-yl-3-[4-(2-sulfamoylphenyl)phenyl]urea Openeye Name: 1-(3-carbamimidoylanilino)-1-isopropyl-3-[4-(2-sulfamoylphenyl)phenyl]urea CAS Name: 1-(3-carbamimidoylanilino)-1-propan-2-yl-3-[4-(2-sulfamoylphenyl)phenyl]urea IUPAC Name: 1-(3-carbamimidoylanilino)-1-propan-2-yl-3-[4-(2-sulfamoylphenyl)phenyl]urea Traditional Name: 1-(3-amidinoanilino)-1-isopropyl-3-[4-(2-sulfamoylphenyl)phenyl]urea Formula: C23H26N6O3S MolecularWeight: 466.55594

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C23H26N6O3S/c1-15(2)29(28-19-7-5-6-17(14-19)22(24)25)23(30)27-18-12-10-16(11-13-18)20-8-3-4-9-21(20)33(26,31)32/h3-15,28H,1-2H3,(H3,24,25)(H,27,30)(H2,26,31,32)