N-(4-acetamidophenyl)-2-(3-butan-2-yl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C22H24N4O3S/c1-4-14(2)26-21(29)18-7-5-6-8-19(18)25-22(26)30-13-20(28)24-17-11-9-16(10-12-17)23-15(3)27/h5-12,14H,4,13H2,1-3H3,(H,23,27)(H,24,28)