1-[1-(3-bromophenyl)-3-oxidanylidene-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propyl]urea

Systemtic Name: 1-[1-(3-bromophenyl)-3-oxidanylidene-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propyl]urea Openeye Name: [1-(3-bromophenyl)-3-oxo-3-[4-[(E)-styryl]sulfonylpiperazin-1-yl]propyl]urea CAS Name: [1-(3-bromophenyl)-3-oxo-3-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]propyl]urea IUPAC Name: [1-(3-bromophenyl)-3-oxo-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propyl]urea Traditional Name: [1-(3-bromophenyl)-3-keto-3-[4-[(E)-styryl]sulfonylpiperazino]propyl]urea Formula: C22H25BrN4O4S MolecularWeight: 521.4273

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC(C2=CC(=CC=C2)Br)NC(=O)N)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)CC(C2=CC(=CC=C2)Br)NC(=O)N)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C22H25BrN4O4S/c23-19-8-4-7-18(15-19)20(25-22(24)29)16-21(28)26-10-12-27(13-11-26)32(30,31)14-9-17-5-2-1-3-6-17/h1-9,14-15,20H,10-13,16H2,(H3,24,25,29)/b14-9+