2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]ethanamide

Systemtic Name: 2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-N-[(3,5-dimethyl-4-oxidanyl-phenyl)methyl]ethanamide Openeye Name: 2-(3-allyl-6-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-[(4-hydroxy-3,5-dimethyl-phenyl)methyl]acetamide CAS Name: 2-[(6-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-N-[(4-hydroxy-3,5-dimethylphenyl)methyl]acetamide IUPAC Name: 2-(6-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-N-[(4-hydroxy-3,5-dimethylphenyl)methyl]acetamide Traditional Name: 2-[(3-allyl-6-chloro-4-keto-quinazolin-2-yl)thio]-N-(4-hydroxy-3,5-dimethyl-benzyl)acetamide Formula: C22H22ClN3O3S MolecularWeight: 443.94638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CNC(=O)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CNC(=O)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

InChI

InChI=1S/C22H22ClN3O3S/c1-4-7-26-21(29)17-10-16(23)5-6-18(17)25-22(26)30-12-19(27)24-11-15-8-13(2)20(28)14(3)9-15/h4-6,8-10,28H,1,7,11-12H2,2-3H3,(H,24,27)