1-[4-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]carbonylphenyl]urea

Systemtic Name: 1-[4-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]carbonylphenyl]urea Openeye Name: [4-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea CAS Name: [4-[[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]phenyl]urea IUPAC Name: [4-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea Traditional Name: [4-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]phenyl]urea Formula: C18H19N5O6S MolecularWeight: 433.43836

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)NC(=O)N)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)NC(=O)N)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O6S/c19-18(25)20-14-6-4-13(5-7-14)17(24)21-8-10-22(11-9-21)30(28,29)16-3-1-2-15(12-16)23(26)27/h1-7,12H,8-11H2,(H3,19,20,25)