[4-(2-pyridin-4-yloxyethyl)phenyl] 4-[(1-methylimidazol-2-yl)sulfanylmethyl]piperidine-1-carboxylate

Systemtic Name: [4-(2-pyridin-4-yloxyethyl)phenyl] 4-[(1-methylimidazol-2-yl)sulfanylmethyl]piperidine-1-carboxylate Openeye Name: [4-[2-(4-pyridyloxy)ethyl]phenyl] 4-[(1-methylimidazol-2-yl)sulfanylmethyl]piperidine-1-carboxylate CAS Name: 4-[[(1-methyl-2-imidazolyl)thio]methyl]-1-piperidinecarboxylic acid [4-(2-pyridin-4-yloxyethyl)phenyl] ester IUPAC Name: [4-(2-pyridin-4-yloxyethyl)phenyl] 4-[(1-methylimidazol-2-yl)sulfanylmethyl]piperidine-1-carboxylate Traditional Name: 4-[[(1-methylimidazol-2-yl)thio]methyl]piperidine-1-carboxylic acid [4-[2-(4-pyridyloxy)ethyl]phenyl] ester Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2CCN(CC2)C(=O)OC3=CC=C(C=C3)CCOC4=CC=NC=C4

Isomeric SMILES

CN1C=CN=C1SCC2CCN(CC2)C(=O)OC3=CC=C(C=C3)CCOC4=CC=NC=C4

InChI

InChI=1S/C24H28N4O3S/c1-27-16-13-26-23(27)32-18-20-8-14-28(15-9-20)24(29)31-22-4-2-19(3-5-22)10-17-30-21-6-11-25-12-7-21/h2-7,11-13,16,20H,8-10,14-15,17-18H2,1H3