2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(phenylmethyl)carbamoyl]ethanamide

Systemtic Name: 2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(phenylmethyl)carbamoyl]ethanamide Openeye Name: N-(benzylcarbamoyl)-2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: 2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-N-[oxo-[(phenylmethyl)amino]methyl]acetamide IUPAC Name: N-(benzylcarbamoyl)-2-(3-butyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(benzylcarbamoyl)-2-[(3-butyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O3S/c1-2-3-13-26-20(28)17-11-7-8-12-18(17)24-22(26)30-15-19(27)25-21(29)23-14-16-9-5-4-6-10-16/h4-12H,2-3,13-15H2,1H3,(H2,23,25,27,29)