tert-butyl 4-[(6-chloranyl-2-methylimino-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(6-chloranyl-2-methylimino-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(6-chloro-2-methylimino-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylate CAS Name: 4-[(6-chloro-2-methylimino-1,3-benzothiazol-3-yl)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(6-chloro-2-methylimino-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylate Traditional Name: 4-[(6-chloro-2-methylimino-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H26ClN3O2S MolecularWeight: 395.94664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CN2C3=C(C=C(C=C3)Cl)SC2=NC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CN2C3=C(C=C(C=C3)Cl)SC2=NC

InChI

InChI=1S/C19H26ClN3O2S/c1-19(2,3)25-18(24)22-9-7-13(8-10-22)12-23-15-6-5-14(20)11-16(15)26-17(23)21-4/h5-6,11,13H,7-10,12H2,1-4H3