N-[(4-chlorophenyl)methyl]-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(4-chlorobenzyl)-2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C22H24ClN3O2S MolecularWeight: 429.96286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClN3O2S/c1-15(2)11-12-26-21(28)18-5-3-4-6-19(18)25-22(26)29-14-20(27)24-13-16-7-9-17(23)10-8-16/h3-10,15H,11-14H2,1-2H3,(H,24,27)