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

Systemtic Name: 2-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-5-(4-methoxyphenyl)-4-methyl-1,2,4-triazole-3-thione Openeye Name: 2-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-5-(4-methoxyphenyl)-4-methyl-1,2,4-triazole-3-thione CAS Name: 2-[[2-(4-ethoxyphenyl)-1-pyrrolidinyl]methyl]-5-(4-methoxyphenyl)-4-methyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[2-(4-ethoxyphenyl)pyrrolidin-1-yl]methyl]-5-(4-methoxyphenyl)-4-methyl-1,2,4-triazole-3-thione Traditional Name: 5-(4-methoxyphenyl)-4-methyl-2-[(2-p-phenetylpyrrolidino)methyl]-1,2,4-triazole-3-thione Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O2S/c1-4-29-20-13-7-17(8-14-20)21-6-5-15-26(21)16-27-23(30)25(2)22(24-27)18-9-11-19(28-3)12-10-18/h7-14,21H,4-6,15-16H2,1-3H3