1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-[2-(3,5-dimethylanilino)-2-oxo-ethyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-[2-(3,5-dimethylanilino)-2-oxoethyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-[2-(3,5-dimethylanilino)-2-keto-ethyl]-N-(6-ethoxy-1,3-benzothiazol-2-yl)isonipecotamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)CC(=O)NC4=CC(=CC(=C4)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCN(CC3)CC(=O)NC4=CC(=CC(=C4)C)C

InChI

InChI=1S/C25H30N4O3S/c1-4-32-20-5-6-21-22(14-20)33-25(27-21)28-24(31)18-7-9-29(10-8-18)15-23(30)26-19-12-16(2)11-17(3)13-19/h5-6,11-14,18H,4,7-10,15H2,1-3H3,(H,26,30)(H,27,28,31)