4-[[4-[5-(4-fluorophenyl)thiophen-2-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[5-(4-fluorophenyl)thiophen-2-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[5-(4-fluorophenyl)thiophene-2-carbonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[5-(4-fluorophenyl)-2-thiophenyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[5-(4-fluorophenyl)thiophene-2-carbonyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[5-(4-fluorophenyl)thiophene-2-carbonyl]piperazino]methyl]benzonitrile Formula: C23H20FN3OS MolecularWeight: 405.487803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=C(S3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=C(S3)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H20FN3OS/c24-20-7-5-19(6-8-20)21-9-10-22(29-21)23(28)27-13-11-26(12-14-27)16-18-3-1-17(15-25)2-4-18/h1-10H,11-14,16H2