2-(4-fluorophenyl)-2-(4-thiophen-3-ylcarbonylpiperazin-1-yl)ethanenitrile

Systemtic Name: 2-(4-fluorophenyl)-2-(4-thiophen-3-ylcarbonylpiperazin-1-yl)ethanenitrile Openeye Name: 2-(4-fluorophenyl)-2-[4-(thiophene-3-carbonyl)piperazin-1-yl]acetonitrile CAS Name: 2-(4-fluorophenyl)-2-[4-[oxo(3-thiophenyl)methyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-(4-fluorophenyl)-2-[4-(thiophene-3-carbonyl)piperazin-1-yl]acetonitrile Traditional Name: 2-(4-fluorophenyl)-2-[4-(3-thenoyl)piperazino]acetonitrile Formula: C17H16FN3OS MolecularWeight: 329.391843

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C#N)C2=CC=C(C=C2)F)C(=O)C3=CSC=C3

Isomeric SMILES

C1CN(CCN1C(C#N)C2=CC=C(C=C2)F)C(=O)C3=CSC=C3

InChI

InChI=1S/C17H16FN3OS/c18-15-3-1-13(2-4-15)16(11-19)20-6-8-21(9-7-20)17(22)14-5-10-23-12-14/h1-5,10,12,16H,6-9H2