2-chloranyl-7,8-dimethyl-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline

Systemtic Name: 2-chloranyl-7,8-dimethyl-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Openeye Name: 2-chloro-7,8-dimethyl-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline CAS Name: 2-chloro-7,8-dimethyl-3-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]quinoline IUPAC Name: 2-chloro-7,8-dimethyl-3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]quinoline Traditional Name: 2-chloro-7,8-dimethyl-3-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]quinoline Formula: C15H15ClN4S MolecularWeight: 318.8244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)CSC3=NNC(=N3)C)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)CSC3=NNC(=N3)C)Cl)C

InChI

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