tert-butyl 4-[5-[2-(4-methoxycarbonylpiperidin-1-yl)ethylcarbamoyl]-1,3,4-thiadiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-[2-(4-methoxycarbonylpiperidin-1-yl)ethylcarbamoyl]-1,3,4-thiadiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-[2-(4-methoxycarbonyl-1-piperidyl)ethylcarbamoyl]-1,3,4-thiadiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[5-[[2-(4-methoxycarbonyl-1-piperidinyl)ethylamino]-oxomethyl]-1,3,4-thiadiazol-2-yl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-[2-(4-methoxycarbonylpiperidin-1-yl)ethylcarbamoyl]-1,3,4-thiadiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[5-[2-(4-carbomethoxypiperidino)ethylcarbamoyl]-1,3,4-thiadiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H35N5O5S MolecularWeight: 481.6088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NN=C(S2)C(=O)NCCN3CCC(CC3)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NN=C(S2)C(=O)NCCN3CCC(CC3)C(=O)OC

InChI

InChI=1S/C22H35N5O5S/c1-22(2,3)32-21(30)27-12-7-15(8-13-27)18-24-25-19(33-18)17(28)23-9-14-26-10-5-16(6-11-26)20(29)31-4/h15-16H,5-14H2,1-4H3,(H,23,28)