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

Systemtic Name: 2-chloranyl-3-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Openeye Name: 2-chloro-3-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline CAS Name: 2-chloro-3-[[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]quinoline IUPAC Name: 2-chloro-3-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Traditional Name: 2-chloro-3-[[(4,5-dimethyl-1,2,4-triazol-3-yl)thio]methyl]quinoline Formula: C14H13ClN4S MolecularWeight: 304.79782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC2=CC3=CC=CC=C3N=C2Cl

Isomeric SMILES

CC1=NN=C(N1C)SCC2=CC3=CC=CC=C3N=C2Cl

InChI

InChI=1S/C14H13ClN4S/c1-9-17-18-14(19(9)2)20-8-11-7-10-5-3-4-6-12(10)16-13(11)15/h3-7H,8H2,1-2H3