ethyl 1-[5-(5-tert-butyl-2-methyl-phenyl)sulfanylfuran-2-yl]carbonylpiperidine-2-carboxylate

Systemtic Name: ethyl 1-[5-(5-tert-butyl-2-methyl-phenyl)sulfanylfuran-2-yl]carbonylpiperidine-2-carboxylate Openeye Name: ethyl 1-[5-(5-tert-butyl-2-methyl-phenyl)sulfanylfuran-2-carbonyl]piperidine-2-carboxylate CAS Name: 1-[[5-[(5-tert-butyl-2-methylphenyl)thio]-2-furanyl]-oxomethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-(5-tert-butyl-2-methylphenyl)sulfanylfuran-2-carbonyl]piperidine-2-carboxylate Traditional Name: 1-[5-[(5-tert-butyl-2-methyl-phenyl)thio]-2-furoyl]pipecolinic acid ethyl ester Formula: C24H31NO4S MolecularWeight: 429.57224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C2=CC=C(O2)SC3=C(C=CC(=C3)C(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1CCCCN1C(=O)C2=CC=C(O2)SC3=C(C=CC(=C3)C(C)(C)C)C

InChI

InChI=1S/C24H31NO4S/c1-6-28-23(27)18-9-7-8-14-25(18)22(26)19-12-13-21(29-19)30-20-15-17(24(3,4)5)11-10-16(20)2/h10-13,15,18H,6-9,14H2,1-5H3