(4-ethyl-5-methyl-thiophen-3-yl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (4-ethyl-5-methyl-thiophen-3-yl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Openeye Name: (4-allylpiperazin-4-ium-1-yl)-(4-ethyl-5-methyl-3-thienyl)methanone CAS Name: (4-ethyl-5-methyl-3-thiophenyl)-(4-prop-2-enyl-1-piperazin-4-iumyl)methanone IUPAC Name: (4-ethyl-5-methylthiophen-3-yl)-(4-prop-2-enylpiperazin-4-ium-1-yl)methanone Traditional Name: (4-allylpiperazin-4-ium-1-yl)-(4-ethyl-5-methyl-3-thienyl)methanone Formula: C15H23N2OS+ MolecularWeight: 279.42092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC=C1C(=O)N2CC[NH+](CC2)CC=C)C

Isomeric SMILES

CCC1=C(SC=C1C(=O)N2CC[NH+](CC2)CC=C)C

InChI

InChI=1S/C15H22N2OS/c1-4-6-16-7-9-17(10-8-16)15(18)14-11-19-12(3)13(14)5-2/h4,11H,1,5-10H2,2-3H3/p+1