5-cyclopropyl-4-ethyl-2-[[[(4-fluorophenyl)-phenyl-methyl]-methyl-amino]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 5-cyclopropyl-4-ethyl-2-[[[(4-fluorophenyl)-phenyl-methyl]-methyl-amino]methyl]-1,2,4-triazole-3-thione Openeye Name: 5-cyclopropyl-4-ethyl-2-[[[(4-fluorophenyl)-phenyl-methyl]-methyl-amino]methyl]-1,2,4-triazole-3-thione CAS Name: 5-cyclopropyl-4-ethyl-2-[[[(4-fluorophenyl)-phenylmethyl]-methylamino]methyl]-1,2,4-triazole-3-thione IUPAC Name: 5-cyclopropyl-4-ethyl-2-[[[(4-fluorophenyl)-phenylmethyl]-methylamino]methyl]-1,2,4-triazole-3-thione Traditional Name: 5-cyclopropyl-4-ethyl-2-[[[(4-fluorophenyl)-phenyl-methyl]-methyl-amino]methyl]-1,2,4-triazole-3-thione Formula: C22H25FN4S MolecularWeight: 396.524103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN(C)C(C2=CC=CC=C2)C3=CC=C(C=C3)F)C4CC4

Isomeric SMILES

CCN1C(=NN(C1=S)CN(C)C(C2=CC=CC=C2)C3=CC=C(C=C3)F)C4CC4

InChI

InChI=1S/C22H25FN4S/c1-3-26-21(18-9-10-18)24-27(22(26)28)15-25(2)20(16-7-5-4-6-8-16)17-11-13-19(23)14-12-17/h4-8,11-14,18,20H,3,9-10,15H2,1-2H3