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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-3-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-3-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-(3-chloro-4-methylphenyl)-3-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-(3-chloro-4-methylphenyl)-3-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-3-[(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=C1SCCC(=O)NC3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCCC(=O)NC3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-3-24-19(26)15-6-4-5-7-17(15)23-20(24)27-11-10-18(25)22-14-9-8-13(2)16(21)12-14/h4-9,12H,3,10-11H2,1-2H3,(H,22,25)