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

Systemtic Name: (4-phenylsulfanyl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-2-yl) hydrogen carbonate Openeye Name: (4-phenylsulfanyl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-2-yl) hydrogen carbonate CAS Name: carbonic acid [4-(phenylthio)-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-2-yl] ester IUPAC Name: (4-phenylsulfanyl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-2-yl) hydrogen carbonate Traditional Name: carbonic acid [4-(phenylthio)-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidin-2-yl] ester Formula: C14H13N3O3S MolecularWeight: 303.33632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O3S/c18-14(19)20-12-8-13(21-10-4-2-1-3-5-10)17-7-6-15-9-11(17)16-12/h1-7,9,12-13H,8H2,(H,18,19)