1-(3-carbamimidoylphenyl)-3-[4-[(4-nitrophenyl)methylsulfamoyl]phenyl]urea

Systemtic Name: 1-(3-carbamimidoylphenyl)-3-[4-[(4-nitrophenyl)methylsulfamoyl]phenyl]urea Openeye Name: 1-(3-carbamimidoylphenyl)-3-[4-[(4-nitrophenyl)methylsulfamoyl]phenyl]urea CAS Name: 1-(3-carbamimidoylphenyl)-3-[4-[(4-nitrophenyl)methylsulfamoyl]phenyl]urea IUPAC Name: 1-(3-carbamimidoylphenyl)-3-[4-[(4-nitrophenyl)methylsulfamoyl]phenyl]urea Traditional Name: 1-(3-amidinophenyl)-3-[4-[(4-nitrobenzyl)sulfamoyl]phenyl]urea Formula: C21H20N6O5S MolecularWeight: 468.4857

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=C(C=C3)[N+](=O)[O-])C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=C(C=C3)[N+](=O)[O-])C(=N)N

InChI

InChI=1S/C21H20N6O5S/c22-20(23)15-2-1-3-17(12-15)26-21(28)25-16-6-10-19(11-7-16)33(31,32)24-13-14-4-8-18(9-5-14)27(29)30/h1-12,24H,13H2,(H3,22,23)(H2,25,26,28)