2-[4-[2-[4-(1,3-thiazol-2-ylmethoxy)phenyl]ethanoyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[2-[4-(1,3-thiazol-2-ylmethoxy)phenyl]ethanoyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[2-[4-(thiazol-2-ylmethoxy)phenyl]acetyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[1-oxo-2-[4-(2-thiazolylmethoxy)phenyl]ethyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[2-[4-(1,3-thiazol-2-ylmethoxy)phenyl]acetyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[2-[4-(thiazol-2-ylmethoxy)phenyl]acetyl]piperazino]nicotinonitrile Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=N2)C#N)C(=O)CC3=CC=C(C=C3)OCC4=NC=CS4

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=N2)C#N)C(=O)CC3=CC=C(C=C3)OCC4=NC=CS4

InChI

InChI=1S/C22H21N5O2S/c23-15-18-2-1-7-25-22(18)27-11-9-26(10-12-27)21(28)14-17-3-5-19(6-4-17)29-16-20-24-8-13-30-20/h1-8,13H,9-12,14,16H2