4-azanyl-8-butyl-9-methylsulfanyl-6-oxidanylidene-pyrido[1,2-a]pyrimidine-3,7-dicarbonitrile

Systemtic Name: 4-azanyl-8-butyl-9-methylsulfanyl-6-oxidanylidene-pyrido[1,2-a]pyrimidine-3,7-dicarbonitrile Openeye Name: 4-amino-8-butyl-9-methylsulfanyl-6-oxo-pyrido[1,2-a]pyrimidine-3,7-dicarbonitrile CAS Name: 4-amino-8-butyl-9-(methylthio)-6-oxopyrido[1,2-a]pyrimidine-3,7-dicarbonitrile IUPAC Name: 4-amino-8-butyl-9-methylsulfanyl-6-oxopyrido[1,2-a]pyrimidine-3,7-dicarbonitrile Traditional Name: 4-amino-8-butyl-6-keto-9-(methylthio)pyrido[1,2-a]pyrimidine-3,7-dicarbonitrile Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)N2C(=C(C=NC2=C1SC)C#N)N)C#N

Isomeric SMILES

CCCCC1=C(C(=O)N2C(=C(C=NC2=C1SC)C#N)N)C#N

InChI

InChI=1S/C15H15N5OS/c1-3-4-5-10-11(7-17)15(21)20-13(18)9(6-16)8-19-14(20)12(10)22-2/h8H,3-5,18H2,1-2H3