[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-[4-(2-thienylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-[4-(thiophen-2-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-[4-(thiophen-2-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [1-benzyl-3-(2-thienyl)pyrazol-4-yl]-[4-(2-thenyl)piperazin-4-ium-1-yl]methanone Formula: C24H25N4OS2+ MolecularWeight: 449.6115

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)C3=CN(N=C3C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C24H24N4OS2/c29-24(27-12-10-26(11-13-27)17-20-8-4-14-30-20)21-18-28(16-19-6-2-1-3-7-19)25-23(21)22-9-5-15-31-22/h1-9,14-15,18H,10-13,16-17H2/p+1