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

Systemtic Name: 2-chloranyl-3-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 2-chloro-3-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 2-chloro-3-[[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 2-chloro-3-[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 2-chloro-3-[[[4-(2,4-dimethylphenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline Formula: C20H17ClN4S MolecularWeight: 380.89378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=NN=C2SCC3=CC4=CC=CC=C4N=C3Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=NN=C2SCC3=CC4=CC=CC=C4N=C3Cl)C

InChI

InChI=1S/C20H17ClN4S/c1-13-7-8-18(14(2)9-13)25-12-22-24-20(25)26-11-16-10-15-5-3-4-6-17(15)23-19(16)21/h3-10,12H,11H2,1-2H3