2-[6-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-8-ethoxy-2,2-dimethyl-chromen-4-yl]butan-2-ol

Systemtic Name: 2-[6-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-8-ethoxy-2,2-dimethyl-chromen-4-yl]butan-2-ol Openeye Name: 2-[6-[(2,4-diaminopyrimidin-5-yl)methyl]-8-ethoxy-2,2-dimethyl-chromen-4-yl]butan-2-ol CAS Name: 2-[6-[(2,4-diamino-5-pyrimidinyl)methyl]-8-ethoxy-2,2-dimethyl-1-benzopyran-4-yl]-2-butanol IUPAC Name: 2-[6-[(2,4-diaminopyrimidin-5-yl)methyl]-8-ethoxy-2,2-dimethylchromen-4-yl]butan-2-ol Traditional Name: 2-[6-[(2,4-diaminopyrimidin-5-yl)methyl]-8-ethoxy-2,2-dimethyl-chromen-4-yl]butan-2-ol Formula: C22H30N4O3 MolecularWeight: 398.4986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C1=CC(OC2=C(C=C(C=C12)CC3=CN=C(N=C3N)N)OCC)(C)C)O

Isomeric SMILES

CCC(C)(C1=CC(OC2=C(C=C(C=C12)CC3=CN=C(N=C3N)N)OCC)(C)C)O

InChI

InChI=1S/C22H30N4O3/c1-6-22(5,27)16-11-21(3,4)29-18-15(16)9-13(10-17(18)28-7-2)8-14-12-25-20(24)26-19(14)23/h9-12,27H,6-8H2,1-5H3,(H4,23,24,25,26)