N-(3-imidazol-1-ylpropyl)-2-[1-[(4-methoxyphenyl)carbamothioyl]piperidin-4-yl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-[1-[(4-methoxyphenyl)carbamothioyl]piperidin-4-yl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-(3-imidazol-1-ylpropyl)-2-[1-[(4-methoxyphenyl)carbamothioyl]-4-piperidyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-2-[1-[(4-methoxyanilino)-sulfanylidenemethyl]-4-piperidinyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-2-[1-[(4-methoxyphenyl)carbamothioyl]piperidin-4-yl]-6-methylpyridine-3-carboxamide Traditional Name: N-(3-imidazol-1-ylpropyl)-2-[1-[(4-methoxyphenyl)thiocarbamoyl]-4-piperidyl]-6-methyl-nicotinamide Formula: C26H32N6O2S MolecularWeight: 492.63628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=S)NC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCCN2C=CN=C2)C3CCN(CC3)C(=S)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C26H32N6O2S/c1-19-4-9-23(25(33)28-12-3-14-31-17-13-27-18-31)24(29-19)20-10-15-32(16-11-20)26(35)30-21-5-7-22(34-2)8-6-21/h4-9,13,17-18,20H,3,10-12,14-16H2,1-2H3,(H,28,33)(H,30,35)