3-(azepan-1-ylsulfonyl)-N-(7-fluoranyl-4-oxidanylidene-1H-quinazolin-6-yl)-4-methoxy-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-(7-fluoranyl-4-oxidanylidene-1H-quinazolin-6-yl)-4-methoxy-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-(7-fluoro-4-oxo-1H-quinazolin-6-yl)-4-methoxy-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-(7-fluoro-4-oxo-1H-quinazolin-6-yl)-4-methoxybenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-(7-fluoro-4-oxo-1H-quinazolin-6-yl)-4-methoxybenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(7-fluoro-4-keto-1H-quinazolin-6-yl)-4-methoxy-benzamide Formula: C22H23FN4O5S MolecularWeight: 474.505223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(C=C3C(=C2)C(=O)N=CN3)F)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C=C3C(=C2)C(=O)N=CN3)F)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H23FN4O5S/c1-32-19-7-6-14(10-20(19)33(30,31)27-8-4-2-3-5-9-27)21(28)26-18-11-15-17(12-16(18)23)24-13-25-22(15)29/h6-7,10-13H,2-5,8-9H2,1H3,(H,26,28)(H,24,25,29)