N,N-diethyl-4-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: N,N-diethyl-4-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N,N-diethyl-benzamide CAS Name: N,N-diethyl-4-[[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]amino]benzamide IUPAC Name: N,N-diethyl-4-[[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N,N-diethyl-benzamide Formula: C24H26N4O3S MolecularWeight: 450.55324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

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