2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(p-tolyl)propanamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(4-methylphenyl)propanamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(p-tolyl)propionamide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SC(C)C(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C22H25N3O2S/c1-4-5-14-25-21(27)18-8-6-7-9-19(18)24-22(25)28-16(3)20(26)23-17-12-10-15(2)11-13-17/h6-13,16H,4-5,14H2,1-3H3,(H,23,26)