N-[4,5-dimethyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-[4,5-dimethyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[4,5-dimethyl-3-(3-pyridylmethylcarbamoyl)-2-thienyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[4,5-dimethyl-3-[oxo-(3-pyridinylmethylamino)methyl]-2-thiophenyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[4,5-dimethyl-3-(pyridin-3-ylmethylcarbamoyl)thiophen-2-yl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[4,5-dimethyl-3-(3-pyridylmethylcarbamoyl)-2-thienyl]isonipecotamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NCC2=CN=CC=C2)NC(=O)C3CCN(CC3)C(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NCC2=CN=CC=C2)NC(=O)C3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C21H26N4O3S/c1-13-14(2)29-21(18(13)20(28)23-12-16-5-4-8-22-11-16)24-19(27)17-6-9-25(10-7-17)15(3)26/h4-5,8,11,17H,6-7,9-10,12H2,1-3H3,(H,23,28)(H,24,27)