4-[2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: 4-[2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-(3-allyl-6-chloro-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]benzamide CAS Name: 4-[[2-[(6-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-(6-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[(3-allyl-6-chloro-4-keto-quinazolin-2-yl)thio]acetyl]amino]benzamide Formula: C20H17ClN4O3S MolecularWeight: 428.89198

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C=CCN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C20H17ClN4O3S/c1-2-9-25-19(28)15-10-13(21)5-8-16(15)24-20(25)29-11-17(26)23-14-6-3-12(4-7-14)18(22)27/h2-8,10H,1,9,11H2,(H2,22,27)(H,23,26)