4-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 4-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 4-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 4-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 4-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 4-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-mesityl-butyramide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CCCSC2=NC3=CC=CC=C3C(=O)N2CC=C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CCCSC2=NC3=CC=CC=C3C(=O)N2CC=C)C

InChI

InChI=1S/C24H27N3O2S/c1-5-12-27-23(29)19-9-6-7-10-20(19)25-24(27)30-13-8-11-21(28)26-22-17(3)14-16(2)15-18(22)4/h5-7,9-10,14-15H,1,8,11-13H2,2-4H3,(H,26,28)