4-[[2,4-bis(azanyl)-7-(ethylamino)pteridin-6-yl]methyl-methyl-amino]benzoate

Systemtic Name: 4-[[2,4-bis(azanyl)-7-(ethylamino)pteridin-6-yl]methyl-methyl-amino]benzoate Openeye Name: 4-[[2,4-diamino-7-(ethylamino)pteridin-6-yl]methyl-methyl-amino]benzoate CAS Name: 4-[[2,4-diamino-7-(ethylamino)-6-pteridinyl]methyl-methylamino]benzoate IUPAC Name: 4-[[2,4-diamino-7-(ethylamino)pteridin-6-yl]methyl-methylamino]benzoate Traditional Name: 4-[[2,4-diamino-7-(ethylamino)pteridin-6-yl]methyl-methyl-amino]benzoate Formula: C17H19N8O2- MolecularWeight: 367.38516

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC2=C(C(=NC(=N2)N)N)N=C1CN(C)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CCNC1=NC2=C(C(=NC(=N2)N)N)N=C1CN(C)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C17H20N8O2/c1-3-20-14-11(21-12-13(18)22-17(19)24-15(12)23-14)8-25(2)10-6-4-9(5-7-10)16(26)27/h4-7H,3,8H2,1-2H3,(H,26,27)(H5,18,19,20,22,23,24)/p-1