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

Systemtic Name: 3-chloranyl-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methyl-quinoline Openeye Name: 3-chloro-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methyl-quinoline CAS Name: 3-chloro-2-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-4-methylquinoline IUPAC Name: 3-chloro-2-[(4-ethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methylquinoline Traditional Name: 3-chloro-2-[[(4-ethyl-1,2,4-triazol-3-yl)thio]methyl]-4-methyl-quinoline Formula: C15H15ClN4S MolecularWeight: 318.8244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1SCC2=NC3=CC=CC=C3C(=C2Cl)C

Isomeric SMILES

CCN1C=NN=C1SCC2=NC3=CC=CC=C3C(=C2Cl)C

InChI

InChI=1S/C15H15ClN4S/c1-3-20-9-17-19-15(20)21-8-13-14(16)10(2)11-6-4-5-7-12(11)18-13/h4-7,9H,3,8H2,1-2H3