[4-(2-phenylethynyl)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [4-(2-phenylethynyl)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Openeye Name: [4-(2-phenylethynyl)phenyl]-[4-(3-thienylmethyl)piperazin-1-yl]methanone CAS Name: [4-(2-phenylethynyl)phenyl]-[4-(3-thiophenylmethyl)-1-piperazinyl]methanone IUPAC Name: [4-(2-phenylethynyl)phenyl]-[4-(thiophen-3-ylmethyl)piperazin-1-yl]methanone Traditional Name: [4-(2-phenylethynyl)phenyl]-[4-(3-thenyl)piperazino]methanone Formula: C24H22N2OS MolecularWeight: 386.50928

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC=C2)C(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CSC=C2)C(=O)C3=CC=C(C=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C24H22N2OS/c27-24(26-15-13-25(14-16-26)18-22-12-17-28-19-22)23-10-8-21(9-11-23)7-6-20-4-2-1-3-5-20/h1-5,8-12,17,19H,13-16,18H2