2-(1,3-benzodioxol-5-yl)-5-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-3-ethoxy-phenol

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-5-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-3-ethoxy-phenol Openeye Name: 2-(1,3-benzodioxol-5-yl)-5-[(2,4-diaminopyrimidin-5-yl)methyl]-3-ethoxy-phenol CAS Name: 2-(1,3-benzodioxol-5-yl)-5-[(2,4-diamino-5-pyrimidinyl)methyl]-3-ethoxyphenol IUPAC Name: 2-(1,3-benzodioxol-5-yl)-5-[(2,4-diaminopyrimidin-5-yl)methyl]-3-ethoxyphenol Traditional Name: 2-(1,3-benzodioxol-5-yl)-5-[(2,4-diaminopyrimidin-5-yl)methyl]-3-ethoxy-phenol Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C2=CC3=C(C=C2)OCO3)O)CC4=CN=C(N=C4N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1C2=CC3=C(C=C2)OCO3)O)CC4=CN=C(N=C4N)N

InChI

InChI=1S/C20H20N4O4/c1-2-26-17-7-11(5-13-9-23-20(22)24-19(13)21)6-14(25)18(17)12-3-4-15-16(8-12)28-10-27-15/h3-4,6-9,25H,2,5,10H2,1H3,(H4,21,22,23,24)