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

Systemtic Name: tert-butyl 4-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-(2-methylthiazol-4-yl)phenyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[4-(2-methyl-4-thiazolyl)anilino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-(2-methyl-1,3-thiazol-4-yl)phenyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[4-(2-methylthiazol-4-yl)phenyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=NC(=CS1)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C21H27N3O3S/c1-14-22-18(13-28-14)15-5-7-17(8-6-15)23-19(25)16-9-11-24(12-10-16)20(26)27-21(2,3)4/h5-8,13,16H,9-12H2,1-4H3,(H,23,25)