[4-(2-pyridin-2-ylsulfanylethyl)phenyl] 4-(1-methylimidazol-2-yl)sulfanylpiperidine-1-carboxylate

Systemtic Name: [4-(2-pyridin-2-ylsulfanylethyl)phenyl] 4-(1-methylimidazol-2-yl)sulfanylpiperidine-1-carboxylate Openeye Name: [4-[2-(2-pyridylsulfanyl)ethyl]phenyl] 4-(1-methylimidazol-2-yl)sulfanylpiperidine-1-carboxylate CAS Name: 4-[(1-methyl-2-imidazolyl)thio]-1-piperidinecarboxylic acid [4-[2-(2-pyridinylthio)ethyl]phenyl] ester IUPAC Name: [4-(2-pyridin-2-ylsulfanylethyl)phenyl] 4-(1-methylimidazol-2-yl)sulfanylpiperidine-1-carboxylate Traditional Name: 4-[(1-methylimidazol-2-yl)thio]piperidine-1-carboxylic acid [4-[2-(2-pyridylthio)ethyl]phenyl] ester Formula: C23H26N4O2S2 MolecularWeight: 454.60814

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2CCN(CC2)C(=O)OC3=CC=C(C=C3)CCSC4=CC=CC=N4

Isomeric SMILES

CN1C=CN=C1SC2CCN(CC2)C(=O)OC3=CC=C(C=C3)CCSC4=CC=CC=N4

InChI

InChI=1S/C23H26N4O2S2/c1-26-16-13-25-22(26)31-20-9-14-27(15-10-20)23(28)29-19-7-5-18(6-8-19)11-17-30-21-4-2-3-12-24-21/h2-8,12-13,16,20H,9-11,14-15,17H2,1H3