[4-[(3-methylpyridin-2-yl)methyl]phenyl] 4-(1H-imidazol-2-ylsulfanyl)piperidine-1-carboxylate

Systemtic Name: [4-[(3-methylpyridin-2-yl)methyl]phenyl] 4-(1H-imidazol-2-ylsulfanyl)piperidine-1-carboxylate Openeye Name: [4-[(3-methyl-2-pyridyl)methyl]phenyl] 4-(1H-imidazol-2-ylsulfanyl)piperidine-1-carboxylate CAS Name: 4-(1H-imidazol-2-ylthio)-1-piperidinecarboxylic acid [4-[(3-methyl-2-pyridinyl)methyl]phenyl] ester IUPAC Name: [4-[(3-methylpyridin-2-yl)methyl]phenyl] 4-(1H-imidazol-2-ylsulfanyl)piperidine-1-carboxylate Traditional Name: 4-(1H-imidazol-2-ylthio)piperidine-1-carboxylic acid [4-[(3-methyl-2-pyridyl)methyl]phenyl] ester Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)CC2=CC=C(C=C2)OC(=O)N3CCC(CC3)SC4=NC=CN4

Isomeric SMILES

CC1=C(N=CC=C1)CC2=CC=C(C=C2)OC(=O)N3CCC(CC3)SC4=NC=CN4

InChI

InChI=1S/C22H24N4O2S/c1-16-3-2-10-23-20(16)15-17-4-6-18(7-5-17)28-22(27)26-13-8-19(9-14-26)29-21-24-11-12-25-21/h2-7,10-12,19H,8-9,13-15H2,1H3,(H,24,25)