ethyl 3-[(5-chloranyl-1,3-benzothiazol-2-yl)-ethyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 3-[(5-chloranyl-1,3-benzothiazol-2-yl)-ethyl-carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 3-[(5-chloro-1,3-benzothiazol-2-yl)-ethyl-carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[(5-chloro-1,3-benzothiazol-2-yl)-ethylamino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(5-chloro-1,3-benzothiazol-2-yl)-ethylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[(5-chloro-1,3-benzothiazol-2-yl)-ethyl-carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C18H22ClN3O3S MolecularWeight: 395.90358

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=C(S1)C=CC(=C2)Cl)C(=O)C3CCCN(C3)C(=O)OCC

Isomeric SMILES

CCN(C1=NC2=C(S1)C=CC(=C2)Cl)C(=O)C3CCCN(C3)C(=O)OCC

InChI

InChI=1S/C18H22ClN3O3S/c1-3-22(17-20-14-10-13(19)7-8-15(14)26-17)16(23)12-6-5-9-21(11-12)18(24)25-4-2/h7-8,10,12H,3-6,9,11H2,1-2H3