ethyl 1-[5-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-2-furanyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-2-furoyl]isonipecotic acid ethyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(O2)CSC3=NC4=C(C=CC=C4O3)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(O2)CSC3=NC4=C(C=CC=C4O3)C

InChI

InChI=1S/C22H24N2O5S/c1-3-27-21(26)15-9-11-24(12-10-15)20(25)18-8-7-16(28-18)13-30-22-23-19-14(2)5-4-6-17(19)29-22/h4-8,15H,3,9-13H2,1-2H3