1-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-methylphenoxy)propan-2-ol

Systemtic Name: 1-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-methylphenoxy)propan-2-ol Openeye Name: 1-[[4-cyclohexyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-methylphenoxy)propan-2-ol CAS Name: 1-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-3-(4-methylphenoxy)-2-propanol IUPAC Name: 1-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(4-methylphenoxy)propan-2-ol Traditional Name: 1-[[4-cyclohexyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-3-(4-methylphenoxy)propan-2-ol Formula: C23H29N3O2S2 MolecularWeight: 443.62526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(CSC2=NN=C(N2C3CCCCC3)CC4=CC=CS4)O

Isomeric SMILES

CC1=CC=C(C=C1)OCC(CSC2=NN=C(N2C3CCCCC3)CC4=CC=CS4)O

InChI

InChI=1S/C23H29N3O2S2/c1-17-9-11-20(12-10-17)28-15-19(27)16-30-23-25-24-22(14-21-8-5-13-29-21)26(23)18-6-3-2-4-7-18/h5,8-13,18-19,27H,2-4,6-7,14-16H2,1H3