2-[4-oxidanylidene-3-(3-oxidanylidene-3-piperidin-1-yl-propyl)quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(3-oxidanylidene-3-piperidin-1-yl-propyl)quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-[4-oxo-3-[3-oxo-3-(1-piperidyl)propyl]quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-[[4-oxo-3-[3-oxo-3-(1-piperidinyl)propyl]-2-quinazolinyl]thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-[4-oxo-3-(3-oxo-3-piperidin-1-ylpropyl)quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-[[4-keto-3-(3-keto-3-piperidino-propyl)quinazolin-2-yl]thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C26H31N5O5S2 MolecularWeight: 557.68484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CCN(CC1)C(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C26H31N5O5S2/c27-38(35,36)20-10-8-19(9-11-20)12-14-28-23(32)18-37-26-29-22-7-3-2-6-21(22)25(34)31(26)17-13-24(33)30-15-4-1-5-16-30/h2-3,6-11H,1,4-5,12-18H2,(H,28,32)(H2,27,35,36)