N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C22H19N5O3S MolecularWeight: 433.48296

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4)C5=NC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4)C5=NC=C(C=C5)C#N

InChI

InChI=1S/C22H19N5O3S/c23-10-14-1-4-20(24-11-14)27-7-5-15(6-8-27)21(28)26-22-25-17(12-31-22)16-2-3-18-19(9-16)30-13-29-18/h1-4,9,11-12,15H,5-8,13H2,(H,25,26,28)