(4-phenylsulfanyl-2-pyridin-2-yl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-9-yl) hydrogen carbonate

Systemtic Name: (4-phenylsulfanyl-2-pyridin-2-yl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-9-yl) hydrogen carbonate Openeye Name: [4-phenylsulfanyl-2-(2-pyridyl)-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-9-yl] hydrogen carbonate CAS Name: carbonic acid [4-(phenylthio)-2-(2-pyridinyl)-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-9-yl] ester IUPAC Name: (4-phenylsulfanyl-2-pyridin-2-yl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-9-yl) hydrogen carbonate Traditional Name: carbonic acid [4-(phenylthio)-2-(2-pyridyl)-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-9-yl] ester Formula: C19H16N4O3S MolecularWeight: 380.42034

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C2C(=NC=CN2C1SC3=CC=CC=C3)OC(=O)O)C4=CC=CC=N4

Isomeric SMILES

C1C(N=C2C(=NC=CN2C1SC3=CC=CC=C3)OC(=O)O)C4=CC=CC=N4

InChI

InChI=1S/C19H16N4O3S/c24-19(25)26-18-17-22-15(14-8-4-5-9-20-14)12-16(23(17)11-10-21-18)27-13-6-2-1-3-7-13/h1-11,15-16H,12H2,(H,24,25)