N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methyl-thiophene-2-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methyl-thiophene-2-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methyl-thiophene-2-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-5-methyl-2-thiophenecarboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methylthiophene-2-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-methyl-thiophene-2-carboxamide Formula: C17H21ClN3OS+ MolecularWeight: 350.88614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC2=C(C=CC(=C2)Cl)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(S1)C(=O)NC2=C(C=CC(=C2)Cl)N3CC[NH+](CC3)C

InChI

InChI=1S/C17H20ClN3OS/c1-12-3-6-16(23-12)17(22)19-14-11-13(18)4-5-15(14)21-9-7-20(2)8-10-21/h3-6,11H,7-10H2,1-2H3,(H,19,22)/p+1