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

Systemtic Name: 4-butyl-1-(3-oxidanylidenebutylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-butyl-1-(3-oxobutylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 4-butyl-1-(3-oxobutylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-butyl-1-(3-oxobutylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-butyl-1-(3-ketobutylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCCC(=O)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCCC(=O)C

InChI

InChI=1S/C17H20N4O2S/c1-3-4-10-20-15(23)13-7-5-6-8-14(13)21-16(20)18-19-17(21)24-11-9-12(2)22/h5-8H,3-4,9-11H2,1-2H3