6-ethyl-2-[[4-ethyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one

Systemtic Name: 6-ethyl-2-[[4-ethyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Openeye Name: 6-ethyl-2-[[4-ethyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one CAS Name: 6-ethyl-2-[[[4-ethyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-4-one IUPAC Name: 6-ethyl-2-[[4-ethyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Traditional Name: 6-ethyl-2-[[[4-ethyl-5-[(3-methylphenoxy)methyl]-1,2,4-triazol-3-yl]thio]methyl]-4-quinolone Formula: C24H26N4O2S MolecularWeight: 434.55384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=CC2=O)CSC3=NN=C(N3CC)COC4=CC=CC(=C4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=CC2=O)CSC3=NN=C(N3CC)COC4=CC=CC(=C4)C

InChI

InChI=1S/C24H26N4O2S/c1-4-17-9-10-21-20(12-17)22(29)13-18(25-21)15-31-24-27-26-23(28(24)5-2)14-30-19-8-6-7-16(3)11-19/h6-13H,4-5,14-15H2,1-3H3,(H,25,29)