4-butyl-1-(3-oxidanylpropylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 4-butyl-1-(3-oxidanylpropylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-butyl-1-(3-hydroxypropylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 4-butyl-1-(3-hydroxypropylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-butyl-1-(3-hydroxypropylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-butyl-1-(3-hydroxypropylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C16H20N4O2S MolecularWeight: 332.4206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCCCO

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCCCO

InChI

InChI=1S/C16H20N4O2S/c1-2-3-9-19-14(22)12-7-4-5-8-13(12)20-15(19)17-18-16(20)23-11-6-10-21/h4-5,7-8,21H,2-3,6,9-11H2,1H3