8-[[5-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline

Systemtic Name: 8-[[5-[(2-chloranylphenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Openeye Name: 8-[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline CAS Name: 8-[[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]thio]methyl]quinoline IUPAC Name: 8-[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoline Traditional Name: 8-[[[5-[(2-chlorophenoxy)methyl]-4-cyclopropyl-1,2,4-triazol-3-yl]thio]methyl]quinoline Formula: C22H19ClN4OS MolecularWeight: 422.93046

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC3=CC=CC4=C3N=CC=C4)COC5=CC=CC=C5Cl

Isomeric SMILES

C1CC1N2C(=NN=C2SCC3=CC=CC4=C3N=CC=C4)COC5=CC=CC=C5Cl

InChI

InChI=1S/C22H19ClN4OS/c23-18-8-1-2-9-19(18)28-13-20-25-26-22(27(20)17-10-11-17)29-14-16-6-3-5-15-7-4-12-24-21(15)16/h1-9,12,17H,10-11,13-14H2