N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-1-(2-thenoyl)isonipecotamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CS4)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)NC(=O)C3CCN(CC3)C(=O)C4=CC=CS4)C

InChI

InChI=1S/C23H25N3O2S/c1-16-5-6-17(2)26(16)20-9-7-19(8-10-20)24-22(27)18-11-13-25(14-12-18)23(28)21-4-3-15-29-21/h3-10,15,18H,11-14H2,1-2H3,(H,24,27)