4-butyl-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-butyl-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-1H-1,2,4-triazol-5-one Openeye Name: 4-butyl-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]sulfanyl-1H-1,2,4-triazol-5-one CAS Name: 4-butyl-3-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-1H-1,2,4-triazol-5-one IUPAC Name: 4-butyl-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-1H-1,2,4-triazol-5-one Traditional Name: 4-butyl-3-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]thio]-1H-1,2,4-triazol-5-one Formula: C17H22N4O2S MolecularWeight: 346.44718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)N2CCCC3=CC=CC=C32

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)N2CCCC3=CC=CC=C32

InChI

InChI=1S/C17H22N4O2S/c1-2-3-10-21-16(23)18-19-17(21)24-12-15(22)20-11-6-8-13-7-4-5-9-14(13)20/h4-5,7,9H,2-3,6,8,10-12H2,1H3,(H,18,23)