4-methyl-2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]methyl]-5-phenyl-1,2,4-triazole-3-thione

Systemtic Name: 4-methyl-2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]methyl]-5-phenyl-1,2,4-triazole-3-thione Openeye Name: 4-methyl-2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]methyl]-5-phenyl-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-[[methyl-[[2-(1-pyrrolidinyl)phenyl]methyl]amino]methyl]-5-phenyl-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]methyl]-5-phenyl-1,2,4-triazole-3-thione Traditional Name: 4-methyl-2-[[methyl-(2-pyrrolidinobenzyl)amino]methyl]-5-phenyl-1,2,4-triazole-3-thione Formula: C22H27N5S MolecularWeight: 393.54828

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN(C)CC2=CC=CC=C2N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=NN(C1=S)CN(C)CC2=CC=CC=C2N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H27N5S/c1-24(16-19-12-6-7-13-20(19)26-14-8-9-15-26)17-27-22(28)25(2)21(23-27)18-10-4-3-5-11-18/h3-7,10-13H,8-9,14-17H2,1-2H3