5-methyl-4-(phenylmethyl)-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 5-methyl-4-(phenylmethyl)-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-5-methyl-2-[[2-(3-pyridyl)pyrrolidin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 5-methyl-4-(phenylmethyl)-2-[[2-(3-pyridinyl)-1-pyrrolidinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-5-methyl-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-5-methyl-2-[[2-(3-pyridyl)pyrrolidino]methyl]-1,2,4-triazole-3-thione Formula: C20H23N5S MolecularWeight: 365.49512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=S)N1CC2=CC=CC=C2)CN3CCCC3C4=CN=CC=C4

Isomeric SMILES

CC1=NN(C(=S)N1CC2=CC=CC=C2)CN3CCCC3C4=CN=CC=C4

InChI

InChI=1S/C20H23N5S/c1-16-22-25(20(26)24(16)14-17-7-3-2-4-8-17)15-23-12-6-10-19(23)18-9-5-11-21-13-18/h2-5,7-9,11,13,19H,6,10,12,14-15H2,1H3