methyl 4-[5-[4-(4-cyclohexyl-4-methoxy-piperidin-1-yl)phenyl]-1,3,4-thiadiazol-2-yl]benzoate

Systemtic Name: methyl 4-[5-[4-(4-cyclohexyl-4-methoxy-piperidin-1-yl)phenyl]-1,3,4-thiadiazol-2-yl]benzoate Openeye Name: methyl 4-[5-[4-(4-cyclohexyl-4-methoxy-1-piperidyl)phenyl]-1,3,4-thiadiazol-2-yl]benzoate CAS Name: 4-[5-[4-(4-cyclohexyl-4-methoxy-1-piperidinyl)phenyl]-1,3,4-thiadiazol-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-[4-(4-cyclohexyl-4-methoxypiperidin-1-yl)phenyl]-1,3,4-thiadiazol-2-yl]benzoate Traditional Name: 4-[5-[4-(4-cyclohexyl-4-methoxy-piperidino)phenyl]-1,3,4-thiadiazol-2-yl]benzoic acid methyl ester Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)N4CCC(CC4)(C5CCCCC5)OC

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)N4CCC(CC4)(C5CCCCC5)OC

InChI

InChI=1S/C28H33N3O3S/c1-33-27(32)22-10-8-20(9-11-22)25-29-30-26(35-25)21-12-14-24(15-13-21)31-18-16-28(34-2,17-19-31)23-6-4-3-5-7-23/h8-15,23H,3-7,16-19H2,1-2H3