3-[[4-(3-bromanyl-5-carbamimidoyl-phenoxy)-6-oxidanylidene-5H-pyrimido[4,5-b][1,4]oxazin-2-yl]oxy]-N,N-dimethyl-benzamide

Systemtic Name: 3-[[4-(3-bromanyl-5-carbamimidoyl-phenoxy)-6-oxidanylidene-5H-pyrimido[4,5-b][1,4]oxazin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[4-(3-bromo-5-carbamimidoyl-phenoxy)-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[4-(3-bromo-5-carbamimidoylphenoxy)-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[4-(3-bromo-5-carbamimidoylphenoxy)-6-oxo-5H-pyrimido[4,5-b][1,4]oxazin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[4-(3-amidino-5-bromo-phenoxy)-6-keto-5H-pyrimido[4,5-b][1,4]oxazin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C22H19BrN6O5 MolecularWeight: 527.32746

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC(=CC=C1)OC2=NC3=C(C(=N2)OC4=CC(=CC(=C4)C(=N)N)Br)NC(=O)CO3

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)OC2=NC3=C(C(=N2)OC4=CC(=CC(=C4)C(=N)N)Br)NC(=O)CO3

InChI

InChI=1S/C22H19BrN6O5/c1-29(2)21(31)11-4-3-5-14(7-11)34-22-27-19-17(26-16(30)10-32-19)20(28-22)33-15-8-12(18(24)25)6-13(23)9-15/h3-9H,10H2,1-2H3,(H3,24,25)(H,26,30)