1-(2-tert-butylphenoxy)-3-[[4-(oxolan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol

Systemtic Name: 1-(2-tert-butylphenoxy)-3-[[4-(oxolan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol Openeye Name: 1-(2-tert-butylphenoxy)-3-[[5-(1-piperidyl)-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol CAS Name: 1-(2-tert-butylphenoxy)-3-[[4-(2-oxolanylmethyl)-5-(1-piperidinyl)-1,2,4-triazol-3-yl]thio]-2-propanol IUPAC Name: 1-(2-tert-butylphenoxy)-3-[[4-(oxolan-2-ylmethyl)-5-piperidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol Traditional Name: 1-(2-tert-butylphenoxy)-3-[[5-piperidino-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]propan-2-ol Formula: C25H38N4O3S MolecularWeight: 474.65922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OCC(CSC2=NN=C(N2CC3CCCO3)N4CCCCC4)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OCC(CSC2=NN=C(N2CC3CCCO3)N4CCCCC4)O

InChI

InChI=1S/C25H38N4O3S/c1-25(2,3)21-11-5-6-12-22(21)32-17-19(30)18-33-24-27-26-23(28-13-7-4-8-14-28)29(24)16-20-10-9-15-31-20/h5-6,11-12,19-20,30H,4,7-10,13-18H2,1-3H3