4-[4-(1-oxidanylidene-1,4-thiazinan-4-yl)-8-sulfanylidene-5H-pyrimido[5,4-d]pyrimidin-2-yl]piperazine-1-carbaldehyde

Systemtic Name: 4-[4-(1-oxidanylidene-1,4-thiazinan-4-yl)-8-sulfanylidene-5H-pyrimido[5,4-d]pyrimidin-2-yl]piperazine-1-carbaldehyde Openeye Name: 4-[4-(1-oxo-1,4-thiazinan-4-yl)-8-thioxo-5H-pyrimido[5,4-d]pyrimidin-2-yl]piperazine-1-carbaldehyde CAS Name: 4-[4-(1-oxo-1,4-thiazinan-4-yl)-8-sulfanylidene-5H-pyrimido[5,4-d]pyrimidin-2-yl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[4-(1-oxo-1,4-thiazinan-4-yl)-8-sulfanylidene-5H-pyrimido[5,4-d]pyrimidin-2-yl]piperazine-1-carbaldehyde Traditional Name: 4-[4-(1-keto-1,4-thiazinan-4-yl)-8-thioxo-5H-pyrimido[5,4-d]pyrimidin-2-yl]piperazine-1-carbaldehyde Formula: C15H19N7O2S2 MolecularWeight: 393.48706

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C2=NC3=C(C(=N2)N4CCS(=O)CC4)NC=NC3=S

Isomeric SMILES

C1CN(CCN1C=O)C2=NC3=C(C(=N2)N4CCS(=O)CC4)NC=NC3=S

InChI

InChI=1S/C15H19N7O2S2/c23-10-20-1-3-22(4-2-20)15-18-12-11(16-9-17-14(12)25)13(19-15)21-5-7-26(24)8-6-21/h9-10H,1-8H2,(H,16,17,25)