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

Systemtic Name: 2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Openeye Name: 2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one CAS Name: 2-[[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-4-one IUPAC Name: 2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Traditional Name: 2-[[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-4-quinolone Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=O)C3=CC=CC=C3N2)COC4=CC=C(C=C4)OC

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=O)C3=CC=CC=C3N2)COC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H20N4O3S/c1-25-20(12-28-16-9-7-15(27-2)8-10-16)23-24-21(25)29-13-14-11-19(26)17-5-3-4-6-18(17)22-14/h3-11H,12-13H2,1-2H3,(H,22,26)