4-[2-[[2,4-bis(azanyl)pteridin-6-yl]methylamino]ethyl]benzene-1,2-diol

Systemtic Name: 4-[2-[[2,4-bis(azanyl)pteridin-6-yl]methylamino]ethyl]benzene-1,2-diol Openeye Name: 4-[2-[(2,4-diaminopteridin-6-yl)methylamino]ethyl]benzene-1,2-diol CAS Name: 4-[2-[(2,4-diamino-6-pteridinyl)methylamino]ethyl]benzene-1,2-diol IUPAC Name: 4-[2-[(2,4-diaminopteridin-6-yl)methylamino]ethyl]benzene-1,2-diol Traditional Name: 4-[2-[(2,4-diaminopteridin-6-yl)methylamino]ethyl]pyrocatechol Formula: C15H17N7O2 MolecularWeight: 327.34118

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CCNCC2=CN=C3C(=N2)C(=NC(=N3)N)N)O)O

Isomeric SMILES

C1=CC(=C(C=C1CCNCC2=CN=C3C(=N2)C(=NC(=N3)N)N)O)O

InChI

InChI=1S/C15H17N7O2/c16-13-12-14(22-15(17)21-13)19-7-9(20-12)6-18-4-3-8-1-2-10(23)11(24)5-8/h1-2,5,7,18,23-24H,3-4,6H2,(H4,16,17,19,21,22)