2-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[(2R)-2-(4-methoxyphenyl)-1-pyrrolidinyl]methyl]-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-yl]methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[(2R)-2-(4-methoxyphenyl)pyrrolidino]methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C20H22N4OS MolecularWeight: 366.47988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2CN3C(=S)N(C=N3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCCN2CN3C(=S)N(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4OS/c1-25-18-11-9-16(10-12-18)19-8-5-13-22(19)15-24-20(26)23(14-21-24)17-6-3-2-4-7-17/h2-4,6-7,9-12,14,19H,5,8,13,15H2,1H3/t19-/m1/s1