4-[[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[3-(3-thienyl)propanoyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[1-oxo-3-(3-thiophenyl)propyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(3-thiophen-3-ylpropanoyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[3-(3-thienyl)propanoyl]piperazino]methyl]benzonitrile Formula: C19H21N3OS MolecularWeight: 339.45454

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCC3=CSC=C3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)CCC3=CSC=C3

InChI

InChI=1S/C19H21N3OS/c20-13-16-1-3-17(4-2-16)14-21-8-10-22(11-9-21)19(23)6-5-18-7-12-24-15-18/h1-4,7,12,15H,5-6,8-11,14H2