propan-2-yl 2-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name: propan-2-yl 2-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: isopropyl 2-[[4-cyclohexyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]acetate CAS Name: 2-[[4-cyclohexyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[4-cyclohexyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[[4-cyclohexyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]acetic acid isopropyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CSC1=NN=C(N1C2CCCCC2)C3=CC=CO3

Isomeric SMILES

CC(C)OC(=O)CSC1=NN=C(N1C2CCCCC2)C3=CC=CO3

InChI

InChI=1S/C17H23N3O3S/c1-12(2)23-15(21)11-24-17-19-18-16(14-9-6-10-22-14)20(17)13-7-4-3-5-8-13/h6,9-10,12-13H,3-5,7-8,11H2,1-2H3