4-phenylsulfanyl-2-pyridin-2-yl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidine-9-carboxylic acid

Systemtic Name: 4-phenylsulfanyl-2-pyridin-2-yl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidine-9-carboxylic acid Openeye Name: 4-phenylsulfanyl-2-(2-pyridyl)-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidine-9-carboxylic acid CAS Name: 4-(phenylthio)-2-(2-pyridinyl)-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidine-9-carboxylic acid IUPAC Name: 4-phenylsulfanyl-2-pyridin-2-yl-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidine-9-carboxylic acid Traditional Name: 4-(phenylthio)-2-(2-pyridyl)-3,4-dihydro-2H-pyrazino[1,2-a]pyrimidine-9-carboxylic acid Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N4O2S/c24-19(25)17-18-22-15(14-8-4-5-9-20-14)12-16(23(18)11-10-21-17)26-13-6-2-1-3-7-13/h1-11,15-16H,12H2,(H,24,25)