N-[3-(imidazol-1-ylmethyl)phenyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[3-(1-imidazolylmethyl)phenyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[3-(imidazol-1-ylmethyl)phenyl]-1-(2-thenoyl)nipecotamide Formula: C21H22N4O2S MolecularWeight: 394.48998

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC=CC(=C3)CN4C=CN=C4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC=CC(=C3)CN4C=CN=C4

InChI

InChI=1S/C21H22N4O2S/c26-20(17-5-2-9-25(14-17)21(27)19-7-3-11-28-19)23-18-6-1-4-16(12-18)13-24-10-8-22-15-24/h1,3-4,6-8,10-12,15,17H,2,5,9,13-14H2,(H,23,26)