2-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-5-methyl-4-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-5-methyl-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-5-methyl-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[(2R)-2-(4-ethoxyphenyl)-1-pyrrolidinyl]methyl]-5-methyl-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(2R)-2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-5-methyl-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 5-methyl-4-phenyl-2-[[(2R)-2-p-phenetylpyrrolidino]methyl]-1,2,4-triazole-3-thione Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2CN3C(=S)N(C(=N3)C)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2CCCN2CN3C(=S)N(C(=N3)C)C4=CC=CC=C4

InChI

InChI=1S/C22H26N4OS/c1-3-27-20-13-11-18(12-14-20)21-10-7-15-24(21)16-25-22(28)26(17(2)23-25)19-8-5-4-6-9-19/h4-6,8-9,11-14,21H,3,7,10,15-16H2,1-2H3/t21-/m1/s1