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

Systemtic Name: 2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(1,2-oxazol-3-yl)ethanamide Openeye Name: 2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-isoxazol-3-yl-acetamide CAS Name: N-(3-isoxazolyl)-2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: 2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(1,2-oxazol-3-yl)acetamide Traditional Name: 2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-isoxazol-3-yl-acetamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NOC=C3

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=NOC=C3

InChI

InChI=1S/C18H20N4O3S/c1-12(2)7-9-22-17(24)13-5-3-4-6-14(13)19-18(22)26-11-16(23)20-15-8-10-25-21-15/h3-6,8,10,12H,7,9,11H2,1-2H3,(H,20,21,23)