6-[4-(1H-1,2,4-triazol-5-ylsulfanyl)butoxy]-1H-quinolin-2-one

Systemtic Name: 6-[4-(1H-1,2,4-triazol-5-ylsulfanyl)butoxy]-1H-quinolin-2-one Openeye Name: 6-[4-(1H-1,2,4-triazol-5-ylsulfanyl)butoxy]-1H-quinolin-2-one CAS Name: 6-[4-(1H-1,2,4-triazol-5-ylthio)butoxy]-1H-quinolin-2-one IUPAC Name: 6-[4-(1H-1,2,4-triazol-5-ylsulfanyl)butoxy]-1H-quinolin-2-one Traditional Name: 6-[4-(1H-1,2,4-triazol-5-ylthio)butoxy]carbostyril Formula: C15H16N4O2S MolecularWeight: 316.37814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=O)N2)C=C1OCCCCSC3=NC=NN3

Isomeric SMILES

C1=CC2=C(C=CC(=O)N2)C=C1OCCCCSC3=NC=NN3

InChI

InChI=1S/C15H16N4O2S/c20-14-6-3-11-9-12(4-5-13(11)18-14)21-7-1-2-8-22-15-16-10-17-19-15/h3-6,9-10H,1-2,7-8H2,(H,18,20)(H,16,17,19)