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

Systemtic Name: 1,3,4-thiadiazol-2-yl 2-[4-(4-cyclohexyl-4-methoxy-piperidin-1-yl)phenyl]benzoate Openeye Name: 1,3,4-thiadiazol-2-yl 2-[4-(4-cyclohexyl-4-methoxy-1-piperidyl)phenyl]benzoate CAS Name: 2-[4-(4-cyclohexyl-4-methoxy-1-piperidinyl)phenyl]benzoic acid 1,3,4-thiadiazol-2-yl ester IUPAC Name: 1,3,4-thiadiazol-2-yl 2-[4-(4-cyclohexyl-4-methoxypiperidin-1-yl)phenyl]benzoate Traditional Name: 2-[4-(4-cyclohexyl-4-methoxy-piperidino)phenyl]benzoic acid 1,3,4-thiadiazol-2-yl ester Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCN(CC1)C2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC4=NN=CS4)C5CCCCC5

Isomeric SMILES

COC1(CCN(CC1)C2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC4=NN=CS4)C5CCCCC5

InChI

InChI=1S/C27H31N3O3S/c1-32-27(21-7-3-2-4-8-21)15-17-30(18-16-27)22-13-11-20(12-14-22)23-9-5-6-10-24(23)25(31)33-26-29-28-19-34-26/h5-6,9-14,19,21H,2-4,7-8,15-18H2,1H3