1-benzothiophen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: 1-benzothiophen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: benzothiophen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: 1-benzothiophen-3-yl-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: 1-benzothiophen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: benzothiophen-3-yl-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C14H17N2OS+ MolecularWeight: 261.36258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CSC3=CC=CC=C32

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CSC3=CC=CC=C32

InChI

InChI=1S/C14H16N2OS/c1-15-6-8-16(9-7-15)14(17)12-10-18-13-5-3-2-4-11(12)13/h2-5,10H,6-9H2,1H3/p+1