ethyl 4-[[3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-[(4-methylthiazol-2-yl)sulfanylmethyl]benzofuran-2-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[3-[[(4-methyl-2-thiazolyl)thio]methyl]-2-benzofuranyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-[[(4-methylthiazol-2-yl)thio]methyl]benzofuran-2-carbonyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC(=CS4)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4=NC(=CS4)C

InChI

InChI=1S/C22H25N3O4S2/c1-3-28-22(27)25-10-8-15(9-11-25)24-20(26)19-17(13-31-21-23-14(2)12-30-21)16-6-4-5-7-18(16)29-19/h4-7,12,15H,3,8-11,13H2,1-2H3,(H,24,26)