2-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]acetic acid CAS Name: 2-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylthio]acetic acid IUPAC Name: 2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methylthio]acetic acid Formula: C11H10N2O3S MolecularWeight: 250.2737

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CC(=O)N2C=C1)CSCC(=O)O

Isomeric SMILES

C1=CC2=NC(=CC(=O)N2C=C1)CSCC(=O)O

InChI

InChI=1S/C11H10N2O3S/c14-10-5-8(6-17-7-11(15)16)12-9-3-1-2-4-13(9)10/h1-5H,6-7H2,(H,15,16)