(2-ethylthieno[2,3-b]thiophen-5-yl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: (2-ethylthieno[2,3-b]thiophen-5-yl)-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-(2-ethylthieno[2,3-b]thiophen-5-yl)methanone CAS Name: (2-ethyl-5-thieno[2,3-b]thiophenyl)-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-(2-ethylthieno[2,3-b]thiophen-5-yl)methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-(2-ethylthieno[2,3-b]thiophen-5-yl)methanone Formula: C20H23N2OS2+ MolecularWeight: 371.53942

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)SC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC2=C(S1)SC(=C2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C20H22N2OS2/c1-2-17-12-16-13-18(25-20(16)24-17)19(23)22-10-8-21(9-11-22)14-15-6-4-3-5-7-15/h3-7,12-13H,2,8-11,14H2,1H3/p+1