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

Systemtic Name: 3-chloranyl-2-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methyl-quinoline Openeye Name: 3-chloro-2-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methyl-quinoline CAS Name: 3-chloro-2-[[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-4-methylquinoline IUPAC Name: 3-chloro-2-[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]-4-methylquinoline Traditional Name: 3-chloro-2-[[[5-(4-fluorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]methyl]-4-methyl-quinoline Formula: C25H18ClFN4S MolecularWeight: 460.953623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=C(C=C5)F)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(N3C4=CC=CC=C4)C5=CC=C(C=C5)F)Cl

InChI

InChI=1S/C25H18ClFN4S/c1-16-20-9-5-6-10-21(20)28-22(23(16)26)15-32-25-30-29-24(17-11-13-18(27)14-12-17)31(25)19-7-3-2-4-8-19/h2-14H,15H2,1H3