N-methyl-4-morpholin-4-yl-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-methyl-4-morpholin-4-yl-3-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-methyl-4-morpholino-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-methyl-4-(4-morpholinyl)-3-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-methyl-4-morpholin-4-yl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-benzyl-N-methyl-4-morpholino-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C29H33N5O6S MolecularWeight: 579.66722

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)N3CCOCC3)C(=O)N4CCN(CC4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H33N5O6S/c1-30(22-23-5-3-2-4-6-23)41(38,39)26-11-12-28(32-17-19-40-20-18-32)27(21-26)29(35)33-15-13-31(14-16-33)24-7-9-25(10-8-24)34(36)37/h2-12,21H,13-20,22H2,1H3