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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H22N4O3S/c1-2-3-12-25-20(28)16-6-4-5-7-17(16)24-21(25)29-13-18(26)23-15-10-8-14(9-11-15)19(22)27/h4-11H,2-3,12-13H2,1H3,(H2,22,27)(H,23,26)