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

Systemtic Name: 3-chloranyl-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methyl-quinoline Openeye Name: 3-chloro-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methyl-quinoline CAS Name: 3-chloro-2-[[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-4-methylquinoline IUPAC Name: 3-chloro-2-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-4-methylquinoline Traditional Name: 3-chloro-2-[[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)thio]methyl]-4-methyl-quinoline Formula: C17H17ClN4S MolecularWeight: 344.86168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3C4CC4)C)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3C4CC4)C)Cl

InChI

InChI=1S/C17H17ClN4S/c1-10-13-5-3-4-6-14(13)19-15(16(10)18)9-23-17-21-20-11(2)22(17)12-7-8-12/h3-6,12H,7-9H2,1-2H3