2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide

Systemtic Name: 2-[3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide Openeye Name: 2-(3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(2-thienyl)ethylcarbamoyl]acetamide CAS Name: 2-[[3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]-N-[oxo-(2-thiophen-2-ylethylamino)methyl]acetamide IUPAC Name: 2-[3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)acetamide Traditional Name: 2-[(3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-[2-(2-thienyl)ethylcarbamoyl]acetamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCCC3=CC=CS3

Isomeric SMILES

CC(C)CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(=O)NCCC3=CC=CS3

InChI

InChI=1S/C22H26N4O3S2/c1-15(2)10-12-26-20(28)17-7-3-4-8-18(17)24-22(26)31-14-19(27)25-21(29)23-11-9-16-6-5-13-30-16/h3-8,13,15H,9-12,14H2,1-2H3,(H2,23,25,27,29)