1-butylsulfanyl-5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinoline

Systemtic Name: 1-butylsulfanyl-5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinoline Openeye Name: 1-butylsulfanyl-5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinoline CAS Name: 1-(butylthio)-5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinoline IUPAC Name: 1-butylsulfanyl-5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinoline Traditional Name: 1-(butylthio)-5,9-dimethyl-[1,2,4]triazolo[4,3-a]quinoline Formula: C16H19N3S MolecularWeight: 285.40716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C2N1C3=C(C=CC=C3C)C(=C2)C

Isomeric SMILES

CCCCSC1=NN=C2N1C3=C(C=CC=C3C)C(=C2)C

InChI

InChI=1S/C16H19N3S/c1-4-5-9-20-16-18-17-14-10-12(3)13-8-6-7-11(2)15(13)19(14)16/h6-8,10H,4-5,9H2,1-3H3