N-[3-[[6-(1-azanyl-4-oxidanylidene-4-piperazin-1-yl-butyl)-2-oxidanyl-4-oxidanylidene-pyran-3-yl]-cyclopropyl-methyl]phenyl]benzenesulfonamide

Systemtic Name: N-[3-[[6-(1-azanyl-4-oxidanylidene-4-piperazin-1-yl-butyl)-2-oxidanyl-4-oxidanylidene-pyran-3-yl]-cyclopropyl-methyl]phenyl]benzenesulfonamide Openeye Name: N-[3-[[6-(1-amino-4-oxo-4-piperazin-1-yl-butyl)-2-hydroxy-4-oxo-pyran-3-yl]-cyclopropyl-methyl]phenyl]benzenesulfonamide CAS Name: N-[3-[[6-[1-amino-4-oxo-4-(1-piperazinyl)butyl]-2-hydroxy-4-oxo-3-pyranyl]-cyclopropylmethyl]phenyl]benzenesulfonamide IUPAC Name: N-[3-[[6-(1-amino-4-oxo-4-piperazin-1-ylbutyl)-2-hydroxy-4-oxopyran-3-yl]-cyclopropylmethyl]phenyl]benzenesulfonamide Traditional Name: N-[3-[[6-(1-amino-4-keto-4-piperazino-butyl)-2-hydroxy-4-keto-pyran-3-yl]-cyclopropyl-methyl]phenyl]benzenesulfonamide Formula: C29H34N4O6S MolecularWeight: 566.66846

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)C4=C(OC(=CC4=O)C(CCC(=O)N5CCNCC5)N)O

Isomeric SMILES

C1CC1C(C2=CC(=CC=C2)NS(=O)(=O)C3=CC=CC=C3)C4=C(OC(=CC4=O)C(CCC(=O)N5CCNCC5)N)O

InChI

InChI=1S/C29H34N4O6S/c30-23(11-12-26(35)33-15-13-31-14-16-33)25-18-24(34)28(29(36)39-25)27(19-9-10-19)20-5-4-6-21(17-20)32-40(37,38)22-7-2-1-3-8-22/h1-8,17-19,23,27,31-32,36H,9-16,30H2