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

Systemtic Name: 6-chloranyl-2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Openeye Name: 6-chloro-2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one CAS Name: 6-chloro-2-[[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-4-one IUPAC Name: 6-chloro-2-[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-4-one Traditional Name: 6-chloro-2-[[[5-[(4-methoxyphenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-4-quinolone Formula: C21H19ClN4O3S MolecularWeight: 442.91856

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=O)C3=C(N2)C=CC(=C3)Cl)COC4=CC=C(C=C4)OC

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=O)C3=C(N2)C=CC(=C3)Cl)COC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H19ClN4O3S/c1-26-20(11-29-16-6-4-15(28-2)5-7-16)24-25-21(26)30-12-14-10-19(27)17-9-13(22)3-8-18(17)23-14/h3-10H,11-12H2,1-2H3,(H,23,27)