1-(3,4-dihydro-2H-quinolin-1-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one

Systemtic Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one Openeye Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one CAS Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(1H-1,2,4-triazol-5-ylthio)-1-propanone IUPAC Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)propan-1-one Traditional Name: 1-(3,4-dihydro-2H-quinolin-1-yl)-2-(1H-1,2,4-triazol-5-ylthio)propan-1-one Formula: C14H16N4OS MolecularWeight: 288.36804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC=NN3

Isomeric SMILES

CC(C(=O)N1CCCC2=CC=CC=C21)SC3=NC=NN3

InChI

InChI=1S/C14H16N4OS/c1-10(20-14-15-9-16-17-14)13(19)18-8-4-6-11-5-2-3-7-12(11)18/h2-3,5,7,9-10H,4,6,8H2,1H3,(H,15,16,17)