1-ethanoyl-N-[3-(furan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]piperidine-4-carboxamide

Systemtic Name: 1-ethanoyl-N-[3-(furan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-(2-furylmethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-[(2-furanylmethylamino)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-(furan-2-ylmethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[3-(2-furfurylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]isonipecotamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCC4=CC=CO4

Isomeric SMILES

CC(=O)N1CCC(CC1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H27N3O4S/c1-14(26)25-10-8-15(9-11-25)20(27)24-22-19(17-6-2-3-7-18(17)30-22)21(28)23-13-16-5-4-12-29-16/h4-5,12,15H,2-3,6-11,13H2,1H3,(H,23,28)(H,24,27)