4-[2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]benzamide

Systemtic Name: 4-[2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]benzamide CAS Name: 4-[[2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H22N4O3S/c1-13(2)11-25-20(28)16-5-3-4-6-17(16)24-21(25)29-12-18(26)23-15-9-7-14(8-10-15)19(22)27/h3-10,13H,11-12H2,1-2H3,(H2,22,27)(H,23,26)