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

Systemtic Name: tert-butyl 4-[4-[ethyl-(1-oxidanylidene-1-phenyl-propan-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[ethyl-(1-methyl-2-oxo-2-phenyl-ethyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[ethyl-(1-oxo-1-phenylpropan-2-yl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[ethyl-(1-oxo-1-phenylpropan-2-yl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[ethyl-(2-keto-1-methyl-2-phenyl-ethyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(C)C(=O)C1=CC=CC=C1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCN(C(C)C(=O)C1=CC=CC=C1)C(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C25H33N3O4S/c1-6-28(17(2)21(29)18-10-8-7-9-11-18)23(30)20-16-33-22(26-20)19-12-14-27(15-13-19)24(31)32-25(3,4)5/h7-11,16-17,19H,6,12-15H2,1-5H3