N-[3-[(3-chlorophenyl)carbamoyl]-4-ethyl-5-methyl-thiophen-2-yl]-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-[3-[(3-chlorophenyl)carbamoyl]-4-ethyl-5-methyl-thiophen-2-yl]-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-[(3-chlorophenyl)carbamoyl]-4-ethyl-5-methyl-2-thienyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-[(3-chloroanilino)-oxomethyl]-4-ethyl-5-methyl-2-thiophenyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-[(3-chlorophenyl)carbamoyl]-4-ethyl-5-methylthiophen-2-yl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[3-[(3-chlorophenyl)carbamoyl]-4-ethyl-5-methyl-2-thienyl]isonipecotamide Formula: C22H26ClN3O3S MolecularWeight: 447.97814

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)NC2=CC(=CC=C2)Cl)NC(=O)C3CCN(CC3)C(=O)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)NC2=CC(=CC=C2)Cl)NC(=O)C3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C22H26ClN3O3S/c1-4-18-13(2)30-22(19(18)21(29)24-17-7-5-6-16(23)12-17)25-20(28)15-8-10-26(11-9-15)14(3)27/h5-7,12,15H,4,8-11H2,1-3H3,(H,24,29)(H,25,28)