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

Systemtic Name: 4-cyclohexyl-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-cyclohexyl-2-[[2-(3-pyridyl)pyrrolidin-1-yl]methyl]-5-(2-thienylmethyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclohexyl-2-[[2-(3-pyridinyl)-1-pyrrolidinyl]methyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-cyclohexyl-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-5-(thiophen-2-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 4-cyclohexyl-2-[[2-(3-pyridyl)pyrrolidino]methyl]-5-(2-thenyl)-1,2,4-triazole-3-thione Formula: C23H29N5S2 MolecularWeight: 439.63986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN(C2=S)CN3CCCC3C4=CN=CC=C4)CC5=CC=CS5

Isomeric SMILES

C1CCC(CC1)N2C(=NN(C2=S)CN3CCCC3C4=CN=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C23H29N5S2/c29-23-27(17-26-13-5-11-21(26)18-7-4-12-24-16-18)25-22(15-20-10-6-14-30-20)28(23)19-8-2-1-3-9-19/h4,6-7,10,12,14,16,19,21H,1-3,5,8-9,11,13,15,17H2