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

Systemtic Name: tert-butyl 4-[(2-azanylidene-6-methyl-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(2-imino-6-methyl-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylate CAS Name: 4-[(2-imino-6-methyl-1,3-benzothiazol-3-yl)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(2-imino-6-methyl-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylate Traditional Name: 4-[(2-imino-6-methyl-1,3-benzothiazol-3-yl)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H27N3O2S MolecularWeight: 361.50158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=N)S2)CC3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=N)S2)CC3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H27N3O2S/c1-13-5-6-15-16(11-13)25-17(20)22(15)12-14-7-9-21(10-8-14)18(23)24-19(2,3)4/h5-6,11,14,20H,7-10,12H2,1-4H3