4-[2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 4-[2-(3-hexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N,N-dimethyl-benzamide Openeye Name: 4-[[2-(3-hexyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N,N-dimethyl-benzamide CAS Name: 4-[[2-[(3-hexyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 4-[[2-(3-hexyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-N,N-dimethylbenzamide Traditional Name: 4-[[2-[(3-hexyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N,N-dimethyl-benzamide Formula: C25H30N4O3S MolecularWeight: 466.5957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N(C)C

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N(C)C

InChI

InChI=1S/C25H30N4O3S/c1-4-5-6-9-16-29-24(32)20-10-7-8-11-21(20)27-25(29)33-17-22(30)26-19-14-12-18(13-15-19)23(31)28(2)3/h7-8,10-15H,4-6,9,16-17H2,1-3H3,(H,26,30)