1-[3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]urea

Systemtic Name: 1-[3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-1-phenyl-propyl]urea Openeye Name: [3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxo-1-phenyl-propyl]urea CAS Name: [3-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-3-oxo-1-phenylpropyl]urea IUPAC Name: [3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]-3-oxo-1-phenylpropyl]urea Traditional Name: [3-keto-3-[4-(3-nitrophenyl)sulfonylpiperazino]-1-phenyl-propyl]urea Formula: C20H23N5O6S MolecularWeight: 461.49152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O6S/c21-20(27)22-18(15-5-2-1-3-6-15)14-19(26)23-9-11-24(12-10-23)32(30,31)17-8-4-7-16(13-17)25(28)29/h1-8,13,18H,9-12,14H2,(H3,21,22,27)