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

Systemtic Name: 5-chloranyl-8-[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 8-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-chloro-quinoline CAS Name: 5-chloro-8-[[[5-methyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 8-[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-chloroquinoline Traditional Name: 8-[[(4-benzyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-5-chloro-quinoline Formula: C20H17ClN4S MolecularWeight: 380.89378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC2=CC=CC=C2)SCC3=C4C(=C(C=C3)Cl)C=CC=N4

Isomeric SMILES

CC1=NN=C(N1CC2=CC=CC=C2)SCC3=C4C(=C(C=C3)Cl)C=CC=N4

InChI

InChI=1S/C20H17ClN4S/c1-14-23-24-20(25(14)12-15-6-3-2-4-7-15)26-13-16-9-10-18(21)17-8-5-11-22-19(16)17/h2-11H,12-13H2,1H3