2-[1-(1,3-benzothiazol-6-ylcarbonyl)piperidin-4-yl]-N-[(2-ethoxyphenyl)methyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: 2-[1-(1,3-benzothiazol-6-ylcarbonyl)piperidin-4-yl]-N-[(2-ethoxyphenyl)methyl]-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[1-(1,3-benzothiazole-6-carbonyl)-4-piperidyl]-N-[(2-ethoxyphenyl)methyl]-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[1,3-benzothiazol-6-yl(oxo)methyl]-4-piperidinyl]-N-[(2-ethoxyphenyl)methyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-(1,3-benzothiazole-6-carbonyl)piperidin-4-yl]-N-[(2-ethoxyphenyl)methyl]-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(1,3-benzothiazole-6-carbonyl)-4-piperidyl]-N-(2-ethoxybenzyl)-6-methyl-nicotinamide Formula: C29H30N4O3S MolecularWeight: 514.6385

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNC(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CCOC1=CC=CC=C1CNC(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C29H30N4O3S/c1-3-36-25-7-5-4-6-22(25)17-30-28(34)23-10-8-19(2)32-27(23)20-12-14-33(15-13-20)29(35)21-9-11-24-26(16-21)37-18-31-24/h4-11,16,18,20H,3,12-15,17H2,1-2H3,(H,30,34)