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

Systemtic Name: 2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]methyl]-4-phenyl-1,2,4-triazole-3-thione Openeye Name: 2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]methyl]-4-phenyl-1,2,4-triazole-3-thione CAS Name: 2-[[methyl-[[2-(1-pyrrolidinyl)phenyl]methyl]amino]methyl]-4-phenyl-1,2,4-triazole-3-thione IUPAC Name: 2-[[methyl-[(2-pyrrolidin-1-ylphenyl)methyl]amino]methyl]-4-phenyl-1,2,4-triazole-3-thione Traditional Name: 2-[[methyl-(2-pyrrolidinobenzyl)amino]methyl]-4-phenyl-1,2,4-triazole-3-thione Formula: C21H25N5S MolecularWeight: 379.5217

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCC2)CN3C(=S)N(C=N3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCC2)CN3C(=S)N(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H25N5S/c1-23(15-18-9-5-6-12-20(18)24-13-7-8-14-24)17-26-21(27)25(16-22-26)19-10-3-2-4-11-19/h2-6,9-12,16H,7-8,13-15,17H2,1H3