1-(dimethylamino)-3-[4-[[4-phenylazanyl-5-(1,3-thiazol-2-ylsulfanylmethyl)pyrimidin-2-yl]amino]phenoxy]propan-2-ol

Systemtic Name: 1-(dimethylamino)-3-[4-[[4-phenylazanyl-5-(1,3-thiazol-2-ylsulfanylmethyl)pyrimidin-2-yl]amino]phenoxy]propan-2-ol Openeye Name: 1-[4-[[4-anilino-5-(thiazol-2-ylsulfanylmethyl)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol CAS Name: 1-[4-[[4-anilino-5-[(2-thiazolylthio)methyl]-2-pyrimidinyl]amino]phenoxy]-3-(dimethylamino)-2-propanol IUPAC Name: 1-[4-[[4-anilino-5-(1,3-thiazol-2-ylsulfanylmethyl)pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Traditional Name: 1-[4-[[4-anilino-5-[(thiazol-2-ylthio)methyl]pyrimidin-2-yl]amino]phenoxy]-3-(dimethylamino)propan-2-ol Formula: C25H28N6O2S2 MolecularWeight: 508.65882

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)CSC4=NC=CS4)O

Isomeric SMILES

CN(C)CC(COC1=CC=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=CC=C3)CSC4=NC=CS4)O

InChI

InChI=1S/C25H28N6O2S2/c1-31(2)15-21(32)16-33-22-10-8-20(9-11-22)29-24-27-14-18(17-35-25-26-12-13-34-25)23(30-24)28-19-6-4-3-5-7-19/h3-14,21,32H,15-17H2,1-2H3,(H2,27,28,29,30)