N-[3-aminocarbonyl-4-(4-ethylphenyl)-5-methyl-thiophen-2-yl]-1-ethanoyl-piperidine-4-carboxamide

Systemtic Name: N-[3-aminocarbonyl-4-(4-ethylphenyl)-5-methyl-thiophen-2-yl]-1-ethanoyl-piperidine-4-carboxamide Openeye Name: 1-acetyl-N-[3-carbamoyl-4-(4-ethylphenyl)-5-methyl-2-thienyl]piperidine-4-carboxamide CAS Name: 1-acetyl-N-[3-carbamoyl-4-(4-ethylphenyl)-5-methyl-2-thiophenyl]-4-piperidinecarboxamide IUPAC Name: 1-acetyl-N-[3-carbamoyl-4-(4-ethylphenyl)-5-methylthiophen-2-yl]piperidine-4-carboxamide Traditional Name: 1-acetyl-N-[3-carbamoyl-4-(4-ethylphenyl)-5-methyl-2-thienyl]isonipecotamide Formula: C22H27N3O3S MolecularWeight: 413.53308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)N)NC(=O)C3CCN(CC3)C(=O)C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)N)NC(=O)C3CCN(CC3)C(=O)C)C

InChI

InChI=1S/C22H27N3O3S/c1-4-15-5-7-16(8-6-15)18-13(2)29-22(19(18)20(23)27)24-21(28)17-9-11-25(12-10-17)14(3)26/h5-8,17H,4,9-12H2,1-3H3,(H2,23,27)(H,24,28)