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

Systemtic Name: 3-[[4-(3-azanyl-4-carbamimidoyl-phenoxy)-6-oxidanylidene-7-(sulfonylmethyl)-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide Openeye Name: 3-[[4-(3-amino-4-carbamimidoyl-phenoxy)-6-oxo-7-(sulfonylmethyl)-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide CAS Name: 3-[[4-(3-amino-4-carbamimidoylphenoxy)-6-oxo-7-(sulfonylmethyl)-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethylbenzamide IUPAC Name: 3-[[4-(3-amino-4-carbamimidoylphenoxy)-6-oxo-7-(sulfonylmethyl)-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethylbenzamide Traditional Name: 3-[[4-(4-amidino-3-amino-phenoxy)-6-keto-7-(sulfonylmethyl)-7,8-dihydro-5H-pteridin-2-yl]oxy]-N,N-dimethyl-benzamide Formula: C23H22N8O6S MolecularWeight: 538.53578

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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)C(N3)C=S(=O)=O

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)C(N3)C=S(=O)=O

InChI

InChI=1S/C23H22N8O6S/c1-31(2)22(33)11-4-3-5-12(8-11)37-23-29-19-17(28-20(32)16(27-19)10-38(34)35)21(30-23)36-13-6-7-14(18(25)26)15(24)9-13/h3-10,16H,24H2,1-2H3,(H3,25,26)(H,28,32)(H,27,29,30)