ethyl 1-[3-(1,2-benzothiazol-3-ylcarbonylamino)-4-methyl-phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-(1,2-benzothiazol-3-ylcarbonylamino)-4-methyl-phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-(1,2-benzothiazole-3-carbonylamino)-4-methyl-benzoyl]piperidine-4-carboxylate CAS Name: 1-[[3-[[1,2-benzothiazol-3-yl(oxo)methyl]amino]-4-methylphenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(1,2-benzothiazole-3-carbonylamino)-4-methylbenzoyl]piperidine-4-carboxylate Traditional Name: 1-[3-(1,2-benzothiazole-3-carbonylamino)-4-methyl-benzoyl]isonipecotic acid ethyl ester Formula: C24H25N3O4S MolecularWeight: 451.538

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)NC(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)NC(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C24H25N3O4S/c1-3-31-24(30)16-10-12-27(13-11-16)23(29)17-9-8-15(2)19(14-17)25-22(28)21-18-6-4-5-7-20(18)32-26-21/h4-9,14,16H,3,10-13H2,1-2H3,(H,25,28)