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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=CC2=O)CSC3=NN=C(N3C)COC4=C(C=CC(=C4)C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=CC2=O)CSC3=NN=C(N3C)COC4=C(C=CC(=C4)C)C

InChI

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