(4,5-dimethylthiophen-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (4,5-dimethylthiophen-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: (4,5-dimethyl-3-thienyl)-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: (4,5-dimethyl-3-thiophenyl)-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: (4,5-dimethylthiophen-3-yl)-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: (4,5-dimethyl-3-thienyl)-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C13H21N2OS+ MolecularWeight: 253.38364

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CSC(=C2C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CSC(=C2C)C

InChI

InChI=1S/C13H20N2OS/c1-4-14-5-7-15(8-6-14)13(16)12-9-17-11(3)10(12)2/h9H,4-8H2,1-3H3/p+1