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

Systemtic Name: 5-chloranyl-8-[[5-(3-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 5-chloro-8-[[5-(3-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 5-chloro-8-[[[5-(3-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 5-chloro-8-[[5-(3-methoxyphenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 5-chloro-8-[[[5-(3-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=C4)OC

Isomeric SMILES

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

InChI

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