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

Systemtic Name: 1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-N-(2-piperidin-1-ylethyl)piperidine-4-carboxamide Openeye Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-[2-(1-piperidyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[3-(phenylmethyl)-1,2,4-thiadiazol-5-yl]-N-[2-(1-piperidinyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(2-piperidin-1-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(3-benzyl-1,2,4-thiadiazol-5-yl)-N-(2-piperidinoethyl)isonipecotamide Formula: C22H31N5OS MolecularWeight: 413.57944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCNC(=O)C2CCN(CC2)C3=NC(=NS3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCNC(=O)C2CCN(CC2)C3=NC(=NS3)CC4=CC=CC=C4

InChI

InChI=1S/C22H31N5OS/c28-21(23-11-16-26-12-5-2-6-13-26)19-9-14-27(15-10-19)22-24-20(25-29-22)17-18-7-3-1-4-8-18/h1,3-4,7-8,19H,2,5-6,9-17H2,(H,23,28)