2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-(2-cyanophenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-(2-cyanophenyl)ethanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-(2-cyanophenyl)acetamide CAS Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-N-(2-cyanophenyl)acetamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-N-(2-cyanophenyl)acetamide Traditional Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-N-(2-cyanophenyl)acetamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)CC(=O)NC4=CC=CC=C4C#N

InChI

InChI=1S/C21H21N5OS/c22-13-16-5-1-2-6-17(16)23-20(27)14-25-9-11-26(12-10-25)15-21-24-18-7-3-4-8-19(18)28-21/h1-8H,9-12,14-15H2,(H,23,27)