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

Systemtic Name: 2-chloranyl-3-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 2-chloro-3-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 2-chloro-3-[[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 2-chloro-3-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 2-chloro-3-[[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoline Formula: C20H17ClN4S2 MolecularWeight: 412.95878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC4=CC=CC=C4N=C3Cl)CC5=CC=CS5

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC4=CC=CC=C4N=C3Cl)CC5=CC=CS5

InChI

InChI=1S/C20H17ClN4S2/c21-19-14(10-13-4-1-2-6-17(13)22-19)12-27-20-24-23-18(25(20)15-7-8-15)11-16-5-3-9-26-16/h1-6,9-10,15H,7-8,11-12H2