4-butyl-1-(quinolin-8-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one

Systemtic Name: 4-butyl-1-(quinolin-8-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Openeye Name: 4-butyl-1-(8-quinolylmethylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one CAS Name: 4-butyl-1-(8-quinolinylmethylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one IUPAC Name: 4-butyl-1-(quinolin-8-ylmethylsulfanyl)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Traditional Name: 4-butyl-1-(8-quinolylmethylthio)-[1,2,4]triazolo[4,3-a]quinazolin-5-one Formula: C23H21N5OS MolecularWeight: 415.51074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC4=CC=CC5=C4N=CC=C5

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2N3C1=NN=C3SCC4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C23H21N5OS/c1-2-3-14-27-21(29)18-11-4-5-12-19(18)28-22(27)25-26-23(28)30-15-17-9-6-8-16-10-7-13-24-20(16)17/h4-13H,2-3,14-15H2,1H3