5-(4-fluorophenyl)-4-methyl-2-[[(phenylmethyl)-propan-2-yl-amino]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-fluorophenyl)-4-methyl-2-[[(phenylmethyl)-propan-2-yl-amino]methyl]-1,2,4-triazole-3-thione Openeye Name: 2-[[benzyl(isopropyl)amino]methyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole-3-thione CAS Name: 5-(4-fluorophenyl)-4-methyl-2-[[(phenylmethyl)-propan-2-ylamino]methyl]-1,2,4-triazole-3-thione IUPAC Name: 2-[[benzyl(propan-2-yl)amino]methyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole-3-thione Traditional Name: 2-[[benzyl(isopropyl)amino]methyl]-5-(4-fluorophenyl)-4-methyl-1,2,4-triazole-3-thione Formula: C20H23FN4S MolecularWeight: 370.486823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C20H23FN4S/c1-15(2)24(13-16-7-5-4-6-8-16)14-25-20(26)23(3)19(22-25)17-9-11-18(21)12-10-17/h4-12,15H,13-14H2,1-3H3