6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-hexanamide

Systemtic Name: 6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-hexanamide Openeye Name: 6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-hexanamide CAS Name: 6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(5-spiro[1,3-benzodioxole-2,1'-cyclopentane]yl)hexanamide IUPAC Name: 6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-ylhexanamide Traditional Name: 6-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-spiro[1,3-benzodioxole-2,1'-cyclopentane]-5-yl-hexanamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)CCCCCN4C(=O)C5=CC=CC=C5NC4=S

Isomeric SMILES

C1CCC2(C1)OC3=C(O2)C=C(C=C3)NC(=O)CCCCCN4C(=O)C5=CC=CC=C5NC4=S

InChI

InChI=1S/C25H27N3O4S/c29-22(26-17-11-12-20-21(16-17)32-25(31-20)13-5-6-14-25)10-2-1-7-15-28-23(30)18-8-3-4-9-19(18)27-24(28)33/h3-4,8-9,11-12,16H,1-2,5-7,10,13-15H2,(H,26,29)(H,27,33)