4-azanyl-1-butylsulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 4-azanyl-1-butylsulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-amino-1-butylsulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 4-amino-1-(butylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-amino-1-butylsulfanyl-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-amino-1-(butylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C13H15N5OS MolecularWeight: 289.3561

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C2N1C3=CC=CC=C3C(=O)N2N

Isomeric SMILES

CCCCSC1=NN=C2N1C3=CC=CC=C3C(=O)N2N

InChI

InChI=1S/C13H15N5OS/c1-2-3-8-20-13-16-15-12-17(13)10-7-5-4-6-9(10)11(19)18(12)14/h4-7H,2-3,8,14H2,1H3