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

Systemtic Name: 2-[2-(3-butyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 2-[[2-(3-butyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N-cyclopropyl-benzamide CAS Name: 2-[[2-[(3-butyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 2-[[2-(3-butyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-N-cyclopropylbenzamide Traditional Name: 2-[[2-[(3-butyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N-cyclopropyl-benzamide Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3C(=O)NC4CC4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=CC=C3C(=O)NC4CC4

InChI

InChI=1S/C24H26N4O3S/c1-2-3-14-28-23(31)18-9-5-7-11-20(18)27-24(28)32-15-21(29)26-19-10-6-4-8-17(19)22(30)25-16-12-13-16/h4-11,16H,2-3,12-15H2,1H3,(H,25,30)(H,26,29)