N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(5-chloranyl-8-oxidanyl-quinolin-7-yl)methyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(5-chloro-8-hydroxy-7-quinolyl)methyl]-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(5-chloro-8-hydroxy-7-quinolinyl)methyl]-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(5-chloro-8-hydroxyquinolin-7-yl)methyl]-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[(5-chloro-8-hydroxy-7-quinolyl)methyl]-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetamide Formula: C21H17ClN4O3S MolecularWeight: 440.90268

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC(=C4C=CC=NC4=C3O)Cl

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC(=C4C=CC=NC4=C3O)Cl

InChI

InChI=1S/C21H17ClN4O3S/c1-26-20(29)14-5-2-3-7-16(14)25-21(26)30-11-17(27)24-10-12-9-15(22)13-6-4-8-23-18(13)19(12)28/h2-9,28H,10-11H2,1H3,(H,24,27)