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

Systemtic Name: 5-chloranyl-8-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 5-chloro-8-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 5-chloro-8-[[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 5-chloro-8-[[5-(2-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 5-chloro-8-[[[5-(2-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=CC=C4OC

Isomeric SMILES

CN1C(=NN=C1SCC2=C3C(=C(C=C2)Cl)C=CC=N3)C4=CC=CC=C4OC

InChI

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