(4-ethylpiperazin-4-ium-1-yl)-(5-methylthiophen-3-yl)methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-(5-methylthiophen-3-yl)methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(5-methyl-3-thienyl)methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-(5-methyl-3-thiophenyl)methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-(5-methylthiophen-3-yl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(5-methyl-3-thienyl)methanone Formula: C12H19N2OS+ MolecularWeight: 239.35706

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CSC(=C2)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CSC(=C2)C

InChI

InChI=1S/C12H18N2OS/c1-3-13-4-6-14(7-5-13)12(15)11-8-10(2)16-9-11/h8-9H,3-7H2,1-2H3/p+1