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

Systemtic Name: ethyl 1-[5-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[5-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[5-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-2-furanyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]furan-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[5-[[(5-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(O3)C=CC(=C4)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC=C(O2)CSC3=NC4=C(O3)C=CC(=C4)C

InChI

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