1,3,4-thiadiazol-2-yl 4-(5-methoxypentoxy)-2-phenyl-3-piperidin-1-yl-benzoate

Systemtic Name: 1,3,4-thiadiazol-2-yl 4-(5-methoxypentoxy)-2-phenyl-3-piperidin-1-yl-benzoate Openeye Name: 1,3,4-thiadiazol-2-yl 4-(5-methoxypentoxy)-2-phenyl-3-(1-piperidyl)benzoate CAS Name: 4-(5-methoxypentoxy)-2-phenyl-3-(1-piperidinyl)benzoic acid 1,3,4-thiadiazol-2-yl ester IUPAC Name: 1,3,4-thiadiazol-2-yl 4-(5-methoxypentoxy)-2-phenyl-3-piperidin-1-ylbenzoate Traditional Name: 4-(5-methoxypentoxy)-2-phenyl-3-piperidino-benzoic acid 1,3,4-thiadiazol-2-yl ester Formula: C26H31N3O4S MolecularWeight: 481.60704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCCCCOC1=C(C(=C(C=C1)C(=O)OC2=NN=CS2)C3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

COCCCCCOC1=C(C(=C(C=C1)C(=O)OC2=NN=CS2)C3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C26H31N3O4S/c1-31-17-9-4-10-18-32-22-14-13-21(25(30)33-26-28-27-19-34-26)23(20-11-5-2-6-12-20)24(22)29-15-7-3-8-16-29/h2,5-6,11-14,19H,3-4,7-10,15-18H2,1H3