2-[2,6-dimethoxy-4-[[4-(3-methoxyphenyl)sulfanylpyrimidin-2-yl]amino]phenoxy]ethanol

Systemtic Name: 2-[2,6-dimethoxy-4-[[4-(3-methoxyphenyl)sulfanylpyrimidin-2-yl]amino]phenoxy]ethanol Openeye Name: 2-[2,6-dimethoxy-4-[[4-(3-methoxyphenyl)sulfanylpyrimidin-2-yl]amino]phenoxy]ethanol CAS Name: 2-[2,6-dimethoxy-4-[[4-[(3-methoxyphenyl)thio]-2-pyrimidinyl]amino]phenoxy]ethanol IUPAC Name: 2-[2,6-dimethoxy-4-[[4-(3-methoxyphenyl)sulfanylpyrimidin-2-yl]amino]phenoxy]ethanol Traditional Name: 2-[2,6-dimethoxy-4-[[4-[(3-methoxyphenyl)thio]pyrimidin-2-yl]amino]phenoxy]ethanol Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SC2=NC(=NC=C2)NC3=CC(=C(C(=C3)OC)OCCO)OC

Isomeric SMILES

COC1=CC(=CC=C1)SC2=NC(=NC=C2)NC3=CC(=C(C(=C3)OC)OCCO)OC

InChI

InChI=1S/C21H23N3O5S/c1-26-15-5-4-6-16(13-15)30-19-7-8-22-21(24-19)23-14-11-17(27-2)20(29-10-9-25)18(12-14)28-3/h4-8,11-13,25H,9-10H2,1-3H3,(H,22,23,24)