prop-2-ynyl 4-[4-[[methyl(phenyl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: prop-2-ynyl 4-[4-[[methyl(phenyl)amino]carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: prop-2-ynyl 4-[4-[(N-methylanilino)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[(2-methyl-2-phenylhydrazinyl)-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 4-[4-[(N-methylanilino)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(N-methylanilino)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid propargyl ester Formula: C20H22N4O3S MolecularWeight: 398.47868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

Isomeric SMILES

CN(C1=CC=CC=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OCC#C

InChI

InChI=1S/C20H22N4O3S/c1-3-13-27-20(26)24-11-9-15(10-12-24)19-21-17(14-28-19)18(25)22-23(2)16-7-5-4-6-8-16/h1,4-8,14-15H,9-13H2,2H3,(H,22,25)