6-(4-methoxyphenyl)-4-morpholin-4-yl-pteridin-2-amine hydrate hydrochloride

Systemtic Name: 6-(4-methoxyphenyl)-4-morpholin-4-yl-pteridin-2-amine hydrate hydrochloride Openeye Name: 6-(4-methoxyphenyl)-4-morpholino-pteridin-2-amine hydrate hydrochloride CAS Name: 6-(4-methoxyphenyl)-4-(4-morpholinyl)-2-pteridinamine hydrate hydrochloride IUPAC Name: 6-(4-methoxyphenyl)-4-morpholin-4-ylpteridin-2-amine hydrate hydrochloride Traditional Name: [6-(4-methoxyphenyl)-4-morpholino-pteridin-2-yl]amine hydrate hydrochloride Formula: C17H21ClN6O3 MolecularWeight: 392.84004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C3C(=N2)C(=NC(=N3)N)N4CCOCC4.O.Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C3C(=N2)C(=NC(=N3)N)N4CCOCC4.O.Cl

InChI

InChI=1S/C17H18N6O2.ClH.H2O/c1-24-12-4-2-11(3-5-12)13-10-19-15-14(20-13)16(22-17(18)21-15)23-6-8-25-9-7-23;;/h2-5,10H,6-9H2,1H3,(H2,18,19,21,22);1H;1H2