4-[[4-[2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[2-[2-(3-thienyl)thiazol-4-yl]acetyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[1-oxo-2-[2-(3-thiophenyl)-4-thiazolyl]ethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[2-[2-(3-thienyl)thiazol-4-yl]acetyl]piperazino]methyl]benzonitrile Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C21H20N4OS2/c22-12-16-1-3-17(4-2-16)13-24-6-8-25(9-7-24)20(26)11-19-15-28-21(23-19)18-5-10-27-14-18/h1-5,10,14-15H,6-9,11,13H2