1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide

Systemtic Name: 1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Openeye Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-pyridylmethyl)piperidine-3-carboxamide CAS Name: 1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-N-(3-pyridinylmethyl)-3-piperidinecarboxamide IUPAC Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(pyridin-3-ylmethyl)piperidine-3-carboxamide Traditional Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(3-pyridylmethyl)nipecotamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1CC(CN(C1)C2=NC(=NS2)CC3=CC=CC=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H23N5OS/c27-20(23-14-17-8-4-10-22-13-17)18-9-5-11-26(15-18)21-24-19(25-28-21)12-16-6-2-1-3-7-16/h1-4,6-8,10,13,18H,5,9,11-12,14-15H2,(H,23,27)