N-[3-(4-methylpiperazin-4-ium-1-yl)carbonyl-5-phenyl-thiophen-2-yl]ethanamide

Systemtic Name: N-[3-(4-methylpiperazin-4-ium-1-yl)carbonyl-5-phenyl-thiophen-2-yl]ethanamide Openeye Name: N-[3-(4-methylpiperazin-4-ium-1-carbonyl)-5-phenyl-2-thienyl]acetamide CAS Name: N-[3-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]-5-phenyl-2-thiophenyl]acetamide IUPAC Name: N-[3-(4-methylpiperazin-4-ium-1-carbonyl)-5-phenylthiophen-2-yl]acetamide Traditional Name: N-[3-(4-methylpiperazin-4-ium-1-carbonyl)-5-phenyl-2-thienyl]acetamide Formula: C18H22N3O2S+ MolecularWeight: 344.45118

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(S1)C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC(=O)NC1=C(C=C(S1)C2=CC=CC=C2)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C18H21N3O2S/c1-13(22)19-17-15(18(23)21-10-8-20(2)9-11-21)12-16(24-17)14-6-4-3-5-7-14/h3-7,12H,8-11H2,1-2H3,(H,19,22)/p+1