(4-ethylpiperazin-4-ium-1-yl)-(5-methylthiophen-2-yl)methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-(5-methylthiophen-2-yl)methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-(5-methyl-2-thienyl)methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-(5-methyl-2-thiophenyl)methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-(5-methylthiophen-2-yl)methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-(5-methyl-2-thienyl)methanone Formula: C12H19N2OS+ MolecularWeight: 239.35706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC=C(S2)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC=C(S2)C

InChI

InChI=1S/C12H18N2OS/c1-3-13-6-8-14(9-7-13)12(15)11-5-4-10(2)16-11/h4-5H,3,6-9H2,1-2H3/p+1