1-(1-benzothiophen-2-ylmethyl)-N-[4-(1,2,3,4-tetrazol-1-yl)phenyl]piperidine-2-carboxamide

Systemtic Name: 1-(1-benzothiophen-2-ylmethyl)-N-[4-(1,2,3,4-tetrazol-1-yl)phenyl]piperidine-2-carboxamide Openeye Name: 1-(benzothiophen-2-ylmethyl)-N-[4-(tetrazol-1-yl)phenyl]piperidine-2-carboxamide CAS Name: 1-(1-benzothiophen-2-ylmethyl)-N-[4-(1-tetrazolyl)phenyl]-2-piperidinecarboxamide IUPAC Name: 1-(1-benzothiophen-2-ylmethyl)-N-[4-(tetrazol-1-yl)phenyl]piperidine-2-carboxamide Traditional Name: 1-(benzothiophen-2-ylmethyl)-N-[4-(tetrazol-1-yl)phenyl]pipecolinamide Formula: C22H22N6OS MolecularWeight: 418.51468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=CC=C(C=C2)N3C=NN=N3)CC4=CC5=CC=CC=C5S4

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=CC=C(C=C2)N3C=NN=N3)CC4=CC5=CC=CC=C5S4

InChI

InChI=1S/C22H22N6OS/c29-22(24-17-8-10-18(11-9-17)28-15-23-25-26-28)20-6-3-4-12-27(20)14-19-13-16-5-1-2-7-21(16)30-19/h1-2,5,7-11,13,15,20H,3-4,6,12,14H2,(H,24,29)