N-(3-chloranyl-4-methyl-phenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-4-24-19(26)15-7-5-6-8-17(15)23-20(24)27-13(3)18(25)22-14-10-9-12(2)16(21)11-14/h5-11,13H,4H2,1-3H3,(H,22,25)