5-(4-methoxyphenyl)-2-[[(3S)-3-methylpiperidin-1-yl]methyl]-4-propan-2-yl-1,2,4-triazole-3-thione

Systemtic Name: 5-(4-methoxyphenyl)-2-[[(3S)-3-methylpiperidin-1-yl]methyl]-4-propan-2-yl-1,2,4-triazole-3-thione Openeye Name: 4-isopropyl-5-(4-methoxyphenyl)-2-[[(3S)-3-methyl-1-piperidyl]methyl]-1,2,4-triazole-3-thione CAS Name: 5-(4-methoxyphenyl)-2-[[(3S)-3-methyl-1-piperidinyl]methyl]-4-propan-2-yl-1,2,4-triazole-3-thione IUPAC Name: 5-(4-methoxyphenyl)-2-[[(3S)-3-methylpiperidin-1-yl]methyl]-4-propan-2-yl-1,2,4-triazole-3-thione Traditional Name: 4-isopropyl-5-(4-methoxyphenyl)-2-[[(3S)-3-methylpiperidino]methyl]-1,2,4-triazole-3-thione Formula: C19H28N4OS MolecularWeight: 360.51682

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)OC)C(C)C

Isomeric SMILES

C[C@H]1CCCN(C1)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)OC)C(C)C

InChI

InChI=1S/C19H28N4OS/c1-14(2)23-18(16-7-9-17(24-4)10-8-16)20-22(19(23)25)13-21-11-5-6-15(3)12-21/h7-10,14-15H,5-6,11-13H2,1-4H3/t15-/m0/s1