2-[[cyclohexyl-[(4-fluorophenyl)methyl]amino]methyl]-4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[cyclohexyl-[(4-fluorophenyl)methyl]amino]methyl]-4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[cyclohexyl-[(4-fluorophenyl)methyl]amino]methyl]-4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[cyclohexyl-[(4-fluorophenyl)methyl]amino]methyl]-4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazole-3-thione IUPAC Name: 2-[[cyclohexyl-[(4-fluorophenyl)methyl]amino]methyl]-4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[cyclohexyl-(4-fluorobenzyl)amino]methyl]-4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazole-3-thione Formula: C24H28FN5S MolecularWeight: 437.576023

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(CC2=CC=C(C=C2)F)CN3C(=S)N(C(=N3)C4=CN=CC=C4)C5CC5

Isomeric SMILES

C1CCC(CC1)N(CC2=CC=C(C=C2)F)CN3C(=S)N(C(=N3)C4=CN=CC=C4)C5CC5

InChI

InChI=1S/C24H28FN5S/c25-20-10-8-18(9-11-20)16-28(21-6-2-1-3-7-21)17-29-24(31)30(22-12-13-22)23(27-29)19-5-4-14-26-15-19/h4-5,8-11,14-15,21-22H,1-3,6-7,12-13,16-17H2