6-[2-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]hexanamide

Systemtic Name: 6-[2-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]hexanamide Openeye Name: 6-[2-(2-indan-5-yl-2-oxo-ethyl)sulfanyl-4-oxo-quinazolin-3-yl]hexanamide CAS Name: 6-[2-[[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]hexanamide IUPAC Name: 6-[2-[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]hexanamide Traditional Name: 6-[2-[(2-indan-5-yl-2-keto-ethyl)thio]-4-keto-quinazolin-3-yl]hexanamide Formula: C25H27N3O3S MolecularWeight: 449.56518

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CCCCCC(=O)N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CSC3=NC4=CC=CC=C4C(=O)N3CCCCCC(=O)N

InChI

InChI=1S/C25H27N3O3S/c26-23(30)11-2-1-5-14-28-24(31)20-9-3-4-10-21(20)27-25(28)32-16-22(29)19-13-12-17-7-6-8-18(17)15-19/h3-4,9-10,12-13,15H,1-2,5-8,11,14,16H2,(H2,26,30)