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

Systemtic Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-methyl-thiophene-2-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazin-4-iumyl)-3-methylphenyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methylphenyl]-3-methylthiophene-2-carboxamide Traditional Name: N-[4-(4-ethylpiperazin-4-ium-1-yl)-3-methyl-phenyl]-3-methyl-thiophene-2-carboxamide Formula: C19H26N3OS+ MolecularWeight: 344.49424

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3OS/c1-4-21-8-10-22(11-9-21)17-6-5-16(13-15(17)3)20-19(23)18-14(2)7-12-24-18/h5-7,12-13H,4,8-11H2,1-3H3,(H,20,23)/p+1