5-chloranyl-8-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline

Systemtic Name: 5-chloranyl-8-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 5-chloro-8-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 5-chloro-8-[[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 5-chloro-8-[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 5-chloro-8-[[[5-(4-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]quinoline Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=C3C(=C(C=C2)Cl)C=CC=N3)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C(=NN=C1SCC2=C3C(=C(C=C2)Cl)C=CC=N3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H17ClN4OS/c1-25-19(13-5-8-15(26-2)9-6-13)23-24-20(25)27-12-14-7-10-17(21)16-4-3-11-22-18(14)16/h3-11H,12H2,1-2H3