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

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)propanamide Openeye Name: 2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)propanamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-(3-methoxyphenyl)propanamide IUPAC Name: 2-(3-butyl-4-oxoquinazolin-2-yl)sulfanyl-N-(3-methoxyphenyl)propanamide Traditional Name: 2-[(3-butyl-4-keto-quinazolin-2-yl)thio]-N-(3-methoxyphenyl)propionamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O3S/c1-4-5-13-25-21(27)18-11-6-7-12-19(18)24-22(25)29-15(2)20(26)23-16-9-8-10-17(14-16)28-3/h6-12,14-15H,4-5,13H2,1-3H3,(H,23,26)