3-[2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N,N-dimethyl-benzamide

Systemtic Name: 3-[2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-N,N-dimethyl-benzamide Openeye Name: 3-[[2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-N,N-dimethyl-benzamide CAS Name: 3-[[2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-N,N-dimethylbenzamide IUPAC Name: 3-[[2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-N,N-dimethylbenzamide Traditional Name: 3-[[2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-N,N-dimethyl-benzamide Formula: C21H21BrN4O3S MolecularWeight: 489.38544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21BrN4O3S/c1-4-26-20(29)16-11-14(22)8-9-17(16)24-21(26)30-12-18(27)23-15-7-5-6-13(10-15)19(28)25(2)3/h5-11H,4,12H2,1-3H3,(H,23,27)