6-[4-oxidanylidene-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazolin-3-yl]hexanamide

Systemtic Name: 6-[4-oxidanylidene-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazolin-3-yl]hexanamide Openeye Name: 6-[4-oxo-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-quinazolin-3-yl]hexanamide CAS Name: 6-[4-oxo-2-[[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]thio]-3-quinazolinyl]hexanamide IUPAC Name: 6-[4-oxo-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanylquinazolin-3-yl]hexanamide Traditional Name: 6-[4-keto-2-[[2-keto-2-(2,4,5-trimethylphenyl)ethyl]thio]quinazolin-3-yl]hexanamide Formula: C25H29N3O3S MolecularWeight: 451.58106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCCCC(=O)N)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCCCC(=O)N)C)C

InChI

InChI=1S/C25H29N3O3S/c1-16-13-18(3)20(14-17(16)2)22(29)15-32-25-27-21-10-7-6-9-19(21)24(31)28(25)12-8-4-5-11-23(26)30/h6-7,9-10,13-14H,4-5,8,11-12,15H2,1-3H3,(H2,26,30)