ethyl 1-[2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanoyl]piperidine-4-carboxylate CAS Name: 1-[2-[(2-methyl-1,3-benzothiazol-6-yl)amino]-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanoyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(2-methyl-1,3-benzothiazol-6-yl)amino]propanoyl]isonipecotic acid ethyl ester Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C(C)NC2=CC3=C(C=C2)N=C(S3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C(C)NC2=CC3=C(C=C2)N=C(S3)C

InChI

InChI=1S/C19H25N3O3S/c1-4-25-19(24)14-7-9-22(10-8-14)18(23)12(2)20-15-5-6-16-17(11-15)26-13(3)21-16/h5-6,11-12,14,20H,4,7-10H2,1-3H3