6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-[phenyl(pyridin-2-yl)methyl]hexanamide

Systemtic Name: 6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-[phenyl(pyridin-2-yl)methyl]hexanamide Openeye Name: 6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-[phenyl(2-pyridyl)methyl]hexanamide CAS Name: 6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[phenyl(2-pyridinyl)methyl]hexanamide IUPAC Name: 6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-[phenyl(pyridin-2-yl)methyl]hexanamide Traditional Name: 6-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-[phenyl(2-pyridyl)methyl]hexanamide Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=N2)NC(=O)CCCCCN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=N2)NC(=O)CCCCCN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C26H26N4O2S/c31-23(29-24(19-11-3-1-4-12-19)22-15-8-9-17-27-22)16-5-2-10-18-30-25(32)20-13-6-7-14-21(20)28-26(30)33/h1,3-4,6-9,11-15,17,24H,2,5,10,16,18H2,(H,28,33)(H,29,31)