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

Systemtic Name: 2-[1-(1,3-benzothiazol-6-ylcarbonyl)piperidin-4-yl]-N-(3-imidazol-1-ylpropyl)-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[1-(1,3-benzothiazole-6-carbonyl)-4-piperidyl]-N-(3-imidazol-1-ylpropyl)-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[1,3-benzothiazol-6-yl(oxo)methyl]-4-piperidinyl]-N-[3-(1-imidazolyl)propyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-(1,3-benzothiazole-6-carbonyl)piperidin-4-yl]-N-(3-imidazol-1-ylpropyl)-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(1,3-benzothiazole-6-carbonyl)-4-piperidyl]-N-(3-imidazol-1-ylpropyl)-6-methyl-nicotinamide Formula: C26H28N6O2S MolecularWeight: 488.60452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C26H28N6O2S/c1-18-3-5-21(25(33)28-9-2-11-31-14-10-27-16-31)24(30-18)19-7-12-32(13-8-19)26(34)20-4-6-22-23(15-20)35-17-29-22/h3-6,10,14-17,19H,2,7-9,11-13H2,1H3,(H,28,33)