5-azanyl-1-butyl-7-methylsulfanyl-pyrido[4,3-d]pyrimidine-2,4-dione

Systemtic Name: 5-azanyl-1-butyl-7-methylsulfanyl-pyrido[4,3-d]pyrimidine-2,4-dione Openeye Name: 5-amino-1-butyl-7-methylsulfanyl-pyrido[4,3-d]pyrimidine-2,4-dione CAS Name: 5-amino-1-butyl-7-(methylthio)pyrido[4,3-d]pyrimidine-2,4-dione IUPAC Name: 5-amino-1-butyl-7-methylsulfanylpyrido[4,3-d]pyrimidine-2,4-dione Traditional Name: 5-amino-1-butyl-7-(methylthio)pyrido[4,3-d]pyrimidine-2,4-quinone Formula: C12H16N4O2S MolecularWeight: 280.34604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC(=NC(=C2C(=O)NC1=O)N)SC

Isomeric SMILES

CCCCN1C2=CC(=NC(=C2C(=O)NC1=O)N)SC

InChI

InChI=1S/C12H16N4O2S/c1-3-4-5-16-7-6-8(19-2)14-10(13)9(7)11(17)15-12(16)18/h6H,3-5H2,1-2H3,(H2,13,14)(H,15,17,18)