N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-thiophene-2-carboxamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-thiophene-2-carboxamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methylthiophene-2-carboxamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-methyl-thiophene-2-carboxamide Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C=CS3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=C(C=CS3)C

InChI

InChI=1S/C18H23N3OS/c1-3-20-9-11-21(12-10-20)16-7-5-4-6-15(16)19-18(22)17-14(2)8-13-23-17/h4-8,13H,3,9-12H2,1-2H3,(H,19,22)/p+1