5-tert-butyl-2-[(2-thiophen-2-ylpyrrolidin-1-yl)methyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 5-tert-butyl-2-[(2-thiophen-2-ylpyrrolidin-1-yl)methyl]-1H-1,2,4-triazole-3-thione Openeye Name: 5-tert-butyl-2-[[2-(2-thienyl)pyrrolidin-1-yl]methyl]-1H-1,2,4-triazole-3-thione CAS Name: 5-tert-butyl-2-[(2-thiophen-2-yl-1-pyrrolidinyl)methyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 5-tert-butyl-2-[(2-thiophen-2-ylpyrrolidin-1-yl)methyl]-1H-1,2,4-triazole-3-thione Traditional Name: 5-tert-butyl-2-[[2-(2-thienyl)pyrrolidino]methyl]-1H-1,2,4-triazole-3-thione Formula: C15H22N4S2 MolecularWeight: 322.49198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=S)N(N1)CN2CCCC2C3=CC=CS3

Isomeric SMILES

CC(C)(C)C1=NC(=S)N(N1)CN2CCCC2C3=CC=CS3

InChI

InChI=1S/C15H22N4S2/c1-15(2,3)13-16-14(20)19(17-13)10-18-8-4-6-11(18)12-7-5-9-21-12/h5,7,9,11H,4,6,8,10H2,1-3H3,(H,16,17,20)