2-methyl-5-(4-pyrrolidin-1-ylphenyl)-4-(trifluoromethyl)-1,2,4-triazole-3-thione

Systemtic Name: 2-methyl-5-(4-pyrrolidin-1-ylphenyl)-4-(trifluoromethyl)-1,2,4-triazole-3-thione Openeye Name: 2-methyl-5-(4-pyrrolidin-1-ylphenyl)-4-(trifluoromethyl)-1,2,4-triazole-3-thione CAS Name: 2-methyl-5-[4-(1-pyrrolidinyl)phenyl]-4-(trifluoromethyl)-1,2,4-triazole-3-thione IUPAC Name: 2-methyl-5-(4-pyrrolidin-1-ylphenyl)-4-(trifluoromethyl)-1,2,4-triazole-3-thione Traditional Name: 2-methyl-5-(4-pyrrolidinophenyl)-4-(trifluoromethyl)-1,2,4-triazole-3-thione Formula: C14H15F3N4S MolecularWeight: 328.35591

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)N(C(=N1)C2=CC=C(C=C2)N3CCCC3)C(F)(F)F

Isomeric SMILES

CN1C(=S)N(C(=N1)C2=CC=C(C=C2)N3CCCC3)C(F)(F)F

InChI

InChI=1S/C14H15F3N4S/c1-19-13(22)21(14(15,16)17)12(18-19)10-4-6-11(7-5-10)20-8-2-3-9-20/h4-7H,2-3,8-9H2,1H3