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

Systemtic Name: 3-[[7-butan-2-yl-2-(5-carbamimidoyl-2-methoxy-phenoxy)-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methoxy-N,N-dimethyl-benzamide Openeye Name: 3-[[2-(5-carbamimidoyl-2-methoxy-phenoxy)-6-oxo-7-sec-butyl-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methoxy-N,N-dimethyl-benzamide CAS Name: 3-[[7-butan-2-yl-2-(5-carbamimidoyl-2-methoxyphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methoxy-N,N-dimethylbenzamide IUPAC Name: 3-[[7-butan-2-yl-2-(5-carbamimidoyl-2-methoxyphenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methoxy-N,N-dimethylbenzamide Traditional Name: 3-[[2-(5-amidino-2-methoxy-phenoxy)-6-keto-7-sec-butyl-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-methoxy-N,N-dimethyl-benzamide Formula: C28H33N7O6 MolecularWeight: 563.60492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1C(=O)NC2=C(N1)N=C(N=C2OC3=CC(=CC(=C3)C(=O)N(C)C)OC)OC4=C(C=CC(=C4)C(=N)N)OC

Isomeric SMILES

CCC(C)C1C(=O)NC2=C(N1)N=C(N=C2OC3=CC(=CC(=C3)C(=O)N(C)C)OC)OC4=C(C=CC(=C4)C(=N)N)OC

InChI

InChI=1S/C28H33N7O6/c1-7-14(2)21-25(36)32-22-24(31-21)33-28(41-20-12-15(23(29)30)8-9-19(20)39-6)34-26(22)40-18-11-16(27(37)35(3)4)10-17(13-18)38-5/h8-14,21H,7H2,1-6H3,(H3,29,30)(H,32,36)(H,31,33,34)