tert-butyl 4-[4-(1,3-dihydrobenzo[de]isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(1,3-dihydrobenzo[de]isoquinolin-2-ylcarbonyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(1,3-dihydrobenzo[de]isoquinoline-2-carbonyl)thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[1,3-dihydrobenzo[de]isoquinolin-2-yl(oxo)methyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(1,3-dihydrobenzo[de]isoquinoline-2-carbonyl)-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(1,3-dihydrobenzo[de]isoquinoline-2-carbonyl)thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)N3CC4=CC=CC5=C4C(=CC=C5)C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)N3CC4=CC=CC5=C4C(=CC=C5)C3

InChI

InChI=1S/C26H29N3O3S/c1-26(2,3)32-25(31)28-12-10-18(11-13-28)23-27-21(16-33-23)24(30)29-14-19-8-4-6-17-7-5-9-20(15-29)22(17)19/h4-9,16,18H,10-15H2,1-3H3