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

Systemtic Name: 2-[1-(1,3-benzothiazol-6-ylcarbonyl)piperidin-4-yl]-N-(4-imidazol-1-ylphenyl)-6-methyl-pyridine-3-carboxamide Openeye Name: 2-[1-(1,3-benzothiazole-6-carbonyl)-4-piperidyl]-N-(4-imidazol-1-ylphenyl)-6-methyl-pyridine-3-carboxamide CAS Name: 2-[1-[1,3-benzothiazol-6-yl(oxo)methyl]-4-piperidinyl]-N-[4-(1-imidazolyl)phenyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: 2-[1-(1,3-benzothiazole-6-carbonyl)piperidin-4-yl]-N-(4-imidazol-1-ylphenyl)-6-methylpyridine-3-carboxamide Traditional Name: 2-[1-(1,3-benzothiazole-6-carbonyl)-4-piperidyl]-N-(4-imidazol-1-ylphenyl)-6-methyl-nicotinamide Formula: C29H26N6O2S MolecularWeight: 522.62074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)C5=CC6=C(C=C5)N=CS6

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)C5=CC6=C(C=C5)N=CS6

InChI

InChI=1S/C29H26N6O2S/c1-19-2-8-24(28(36)33-22-4-6-23(7-5-22)35-15-12-30-17-35)27(32-19)20-10-13-34(14-11-20)29(37)21-3-9-25-26(16-21)38-18-31-25/h2-9,12,15-18,20H,10-11,13-14H2,1H3,(H,33,36)