3-[[4-(3-azanyl-4-carbamimidoyl-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide

Systemtic Name: 3-[[4-(3-azanyl-4-carbamimidoyl-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[4-(3-amino-4-carbamimidoyl-phenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[4-(3-amino-4-carbamimidoylphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[4-(3-amino-4-carbamimidoylphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[4-(4-amidino-3-amino-phenoxy)-6-keto-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C22H22N8O4 MolecularWeight: 462.46128

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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(=C(C=C4)C(=N)N)N)NC(=O)CN3

Isomeric SMILES

CN(C)C(=O)C1=CC(=CC=C1)OC2=NC3=C(C(=N2)OC4=CC(=C(C=C4)C(=N)N)N)NC(=O)CN3

InChI

InChI=1S/C22H22N8O4/c1-30(2)21(32)11-4-3-5-12(8-11)34-22-28-19-17(27-16(31)10-26-19)20(29-22)33-13-6-7-14(18(24)25)15(23)9-13/h3-9H,10,23H2,1-2H3,(H3,24,25)(H,27,31)(H,26,28,29)