N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(3-pyridylmethyl)piperazin-1-yl]acetamide CAS Name: N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(3-pyridinylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-5-yl)-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]acetamide Traditional Name: N-piazthiol-5-yl-2-[4-(3-pyridylmethyl)piperazino]acetamide Formula: C18H20N6OS MolecularWeight: 368.456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)CC(=O)NC3=CC4=NSN=C4C=C3

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)CC(=O)NC3=CC4=NSN=C4C=C3

InChI

InChI=1S/C18H20N6OS/c25-18(20-15-3-4-16-17(10-15)22-26-21-16)13-24-8-6-23(7-9-24)12-14-2-1-5-19-11-14/h1-5,10-11H,6-9,12-13H2,(H,20,25)