1-(2-tert-butylphenoxy)-3-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol

Systemtic Name: 1-(2-tert-butylphenoxy)-3-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol Openeye Name: 1-(2-tert-butylphenoxy)-3-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propan-2-ol CAS Name: 1-(2-tert-butylphenoxy)-3-[[4-cyclopropyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-2-propanol IUPAC Name: 1-(2-tert-butylphenoxy)-3-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol Traditional Name: 1-(2-tert-butylphenoxy)-3-[[4-cyclopropyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]propan-2-ol Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OCC(CSC2=NN=C(N2C3CC3)C4=CN=CC=C4)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OCC(CSC2=NN=C(N2C3CC3)C4=CN=CC=C4)O

InChI

InChI=1S/C23H28N4O2S/c1-23(2,3)19-8-4-5-9-20(19)29-14-18(28)15-30-22-26-25-21(27(22)17-10-11-17)16-7-6-12-24-13-16/h4-9,12-13,17-18,28H,10-11,14-15H2,1-3H3