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

Systemtic Name: 1-ethanoyl-N-[3-(furan-2-ylmethylcarbamoyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-(2-furylmethylcarbamoyl)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-[(2-furanylmethylamino)-oxomethyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-(furan-2-ylmethylcarbamoyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[3-(2-furfurylcarbamoyl)-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]isonipecotamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C4CCN(CC4)C(=O)C

Isomeric SMILES

CC1CCC2=C(C1)SC(=C2C(=O)NCC3=CC=CO3)NC(=O)C4CCN(CC4)C(=O)C

InChI

InChI=1S/C23H29N3O4S/c1-14-5-6-18-19(12-14)31-23(20(18)22(29)24-13-17-4-3-11-30-17)25-21(28)16-7-9-26(10-8-16)15(2)27/h3-4,11,14,16H,5-10,12-13H2,1-2H3,(H,24,29)(H,25,28)