2-[[4-(1-oxidanylidene-1,4-thiazinan-4-yl)-8-[[3-(trifluoromethyl)phenyl]amino]pyrimido[5,4-d]pyrimidin-2-yl]amino]ethanol

Systemtic Name: 2-[[4-(1-oxidanylidene-1,4-thiazinan-4-yl)-8-[[3-(trifluoromethyl)phenyl]amino]pyrimido[5,4-d]pyrimidin-2-yl]amino]ethanol Openeye Name: 2-[[4-(1-oxo-1,4-thiazinan-4-yl)-8-[3-(trifluoromethyl)anilino]pyrimido[5,4-d]pyrimidin-2-yl]amino]ethanol CAS Name: 2-[[4-(1-oxo-1,4-thiazinan-4-yl)-8-[3-(trifluoromethyl)anilino]-2-pyrimido[5,4-d]pyrimidinyl]amino]ethanol IUPAC Name: 2-[[4-(1-oxo-1,4-thiazinan-4-yl)-8-[3-(trifluoromethyl)anilino]pyrimido[5,4-d]pyrimidin-2-yl]amino]ethanol Traditional Name: 2-[[4-(1-keto-1,4-thiazinan-4-yl)-8-[3-(trifluoromethyl)anilino]pyrimido[5,4-d]pyrimidin-2-yl]amino]ethanol Formula: C19H20F3N7O2S MolecularWeight: 467.46801

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)CCN1C2=NC(=NC3=C2N=CN=C3NC4=CC=CC(=C4)C(F)(F)F)NCCO

Isomeric SMILES

C1CS(=O)CCN1C2=NC(=NC3=C2N=CN=C3NC4=CC=CC(=C4)C(F)(F)F)NCCO

InChI

InChI=1S/C19H20F3N7O2S/c20-19(21,22)12-2-1-3-13(10-12)26-16-14-15(24-11-25-16)17(28-18(27-14)23-4-7-30)29-5-8-32(31)9-6-29/h1-3,10-11,30H,4-9H2,(H,23,27,28)(H,24,25,26)