tert-butyl 4-[[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[5-[(3-chlorophenyl)methyl]thiazol-2-yl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[5-[(3-chlorophenyl)methyl]-2-thiazolyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[5-[(3-chlorophenyl)methyl]-1,3-thiazol-2-yl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[5-(3-chlorobenzyl)thiazol-2-yl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H26ClN3O3S MolecularWeight: 435.96744

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H26ClN3O3S/c1-21(2,3)28-20(27)25-9-7-15(8-10-25)18(26)24-19-23-13-17(29-19)12-14-5-4-6-16(22)11-14/h4-6,11,13,15H,7-10,12H2,1-3H3,(H,23,24,26)