2-butylsulfanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carbaldehyde

Systemtic Name: 2-butylsulfanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidine-3-carbaldehyde Openeye Name: 2-butylsulfanyl-4-oxo-pyrido[1,2-a]pyrimidine-3-carbaldehyde CAS Name: 2-(butylthio)-4-oxo-3-pyrido[1,2-a]pyrimidinecarboxaldehyde IUPAC Name: 2-butylsulfanyl-4-oxopyrido[1,2-a]pyrimidine-3-carbaldehyde Traditional Name: 2-(butylthio)-4-keto-pyrido[1,2-a]pyrimidine-3-carbaldehyde Formula: C13H14N2O2S MolecularWeight: 262.32746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(=O)N2C=CC=CC2=N1)C=O

Isomeric SMILES

CCCCSC1=C(C(=O)N2C=CC=CC2=N1)C=O

InChI

InChI=1S/C13H14N2O2S/c1-2-3-8-18-12-10(9-16)13(17)15-7-5-4-6-11(15)14-12/h4-7,9H,2-3,8H2,1H3