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

Systemtic Name: 1-[(3-carbamimidoylphenyl)amino]-1-(methoxymethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea Openeye Name: 1-(3-carbamimidoylanilino)-1-(methoxymethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea CAS Name: 1-(3-carbamimidoylanilino)-1-(methoxymethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea IUPAC Name: 1-(3-carbamimidoylanilino)-1-(methoxymethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea Traditional Name: 1-(3-amidinoanilino)-1-(methoxymethyl)-3-[4-(2-sulfamoylphenyl)phenyl]urea Formula: C22H24N6O4S MolecularWeight: 468.52876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N6O4S/c1-32-14-28(27-18-6-4-5-16(13-18)21(23)24)22(29)26-17-11-9-15(10-12-17)19-7-2-3-8-20(19)33(25,30)31/h2-13,27H,14H2,1H3,(H3,23,24)(H,26,29)(H2,25,30,31)