2-(2-azanylethylsulfanylmethyl)-7-methyl-pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 2-(2-azanylethylsulfanylmethyl)-7-methyl-pyrido[1,2-a]pyrimidin-4-one Openeye Name: 2-(2-aminoethylsulfanylmethyl)-7-methyl-pyrido[1,2-a]pyrimidin-4-one CAS Name: 2-[(2-aminoethylthio)methyl]-7-methyl-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 2-(2-aminoethylsulfanylmethyl)-7-methylpyrido[1,2-a]pyrimidin-4-one Traditional Name: 2-[(2-aminoethylthio)methyl]-7-methyl-pyrido[1,2-a]pyrimidin-4-one Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)CSCCN)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)CSCCN)C=C1

InChI

InChI=1S/C12H15N3OS/c1-9-2-3-11-14-10(8-17-5-4-13)6-12(16)15(11)7-9/h2-3,6-7H,4-5,8,13H2,1H3