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

Systemtic Name: 2-chloranyl-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7,8-dimethyl-quinoline Openeye Name: 2-chloro-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7,8-dimethyl-quinoline CAS Name: 2-chloro-3-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-7,8-dimethylquinoline IUPAC Name: 2-chloro-3-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]-7,8-dimethylquinoline Traditional Name: 2-chloro-3-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-7,8-dimethyl-quinoline Formula: C20H21ClN4S MolecularWeight: 384.92554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)CSC3=NN=C(N3C4CC4)C5CC5)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)CSC3=NN=C(N3C4CC4)C5CC5)Cl)C

InChI

InChI=1S/C20H21ClN4S/c1-11-3-4-14-9-15(18(21)22-17(14)12(11)2)10-26-20-24-23-19(13-5-6-13)25(20)16-7-8-16/h3-4,9,13,16H,5-8,10H2,1-2H3