2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[3-(7-methyloctyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1,2-oxazol-3-yl)ethanamide Openeye Name: N-isoxazol-3-yl-2-[3-(7-methyloctyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(3-isoxazolyl)-2-[[3-(7-methyloctyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: 2-[3-(7-methyloctyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1,2-oxazol-3-yl)acetamide Traditional Name: N-isoxazol-3-yl-2-[[4-keto-3-(7-methyloctyl)quinazolin-2-yl]thio]acetamide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NOC=C3

Isomeric SMILES

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NOC=C3

InChI

InChI=1S/C22H28N4O3S/c1-16(2)9-5-3-4-8-13-26-21(28)17-10-6-7-11-18(17)23-22(26)30-15-20(27)24-19-12-14-29-25-19/h6-7,10-12,14,16H,3-5,8-9,13,15H2,1-2H3,(H,24,25,27)