6-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)-N-(oxolan-2-ylmethyl)hexanamide

Systemtic Name: 6-(4-oxidanylidene-2-phenacylsulfanyl-quinazolin-3-yl)-N-(oxolan-2-ylmethyl)hexanamide Openeye Name: 6-(4-oxo-2-phenacylsulfanyl-quinazolin-3-yl)-N-(tetrahydrofuran-2-ylmethyl)hexanamide CAS Name: N-(2-oxolanylmethyl)-6-[4-oxo-2-(phenacylthio)-3-quinazolinyl]hexanamide IUPAC Name: N-(oxolan-2-ylmethyl)-6-(4-oxo-2-phenacylsulfanylquinazolin-3-yl)hexanamide Traditional Name: 6-[4-keto-2-(phenacylthio)quinazolin-3-yl]-N-(tetrahydrofurfuryl)hexanamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CC(OC1)CNC(=O)CCCCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O4S/c31-24(20-10-3-1-4-11-20)19-35-27-29-23-14-7-6-13-22(23)26(33)30(27)16-8-2-5-15-25(32)28-18-21-12-9-17-34-21/h1,3-4,6-7,10-11,13-14,21H,2,5,8-9,12,15-19H2,(H,28,32)