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

Systemtic Name: tert-butyl 4-[4-[(1-ethynylcyclohexyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(1-ethynylcyclohexyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[(1-ethynylcyclohexyl)amino]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(1-ethynylcyclohexyl)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[(1-ethynylcyclohexyl)carbamoyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3(CCCCC3)C#C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NC3(CCCCC3)C#C

InChI

InChI=1S/C22H31N3O3S/c1-5-22(11-7-6-8-12-22)24-18(26)17-15-29-19(23-17)16-9-13-25(14-10-16)20(27)28-21(2,3)4/h1,15-16H,6-14H2,2-4H3,(H,24,26)