2-[2-chloranyl-4-(1-oxidanylidene-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-8-yl]sulfanylethanol

Systemtic Name: 2-[2-chloranyl-4-(1-oxidanylidene-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-8-yl]sulfanylethanol Openeye Name: 2-[2-chloro-4-(1-oxo-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-8-yl]sulfanylethanol CAS Name: 2-[[2-chloro-4-(1-oxo-1,4-thiazinan-4-yl)-8-pyrimido[5,4-d]pyrimidinyl]thio]ethanol IUPAC Name: 2-[2-chloro-4-(1-oxo-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-8-yl]sulfanylethanol Traditional Name: 2-[[2-chloro-4-(1-keto-1,4-thiazinan-4-yl)pyrimido[5,4-d]pyrimidin-8-yl]thio]ethanol Formula: C12H14ClN5O2S2 MolecularWeight: 359.85486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)CCN1C2=NC(=NC3=C2N=CN=C3SCCO)Cl

Isomeric SMILES

C1CS(=O)CCN1C2=NC(=NC3=C2N=CN=C3SCCO)Cl

InChI

InChI=1S/C12H14ClN5O2S2/c13-12-16-9-8(14-7-15-11(9)21-4-3-19)10(17-12)18-1-5-22(20)6-2-18/h7,19H,1-6H2