N-(5-octyl-1,3,4-thiadiazol-2-yl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-(5-octyl-1,3,4-thiadiazol-2-yl)-1-(2-thenoyl)nipecotamide Formula: C21H30N4O2S2 MolecularWeight: 434.6185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NN=C(S1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

Isomeric SMILES

CCCCCCCCC1=NN=C(S1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3

InChI

InChI=1S/C21H30N4O2S2/c1-2-3-4-5-6-7-12-18-23-24-21(29-18)22-19(26)16-10-8-13-25(15-16)20(27)17-11-9-14-28-17/h9,11,14,16H,2-8,10,12-13,15H2,1H3,(H,22,24,26)