N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-(2-thienyl)butanamide CAS Name: N-[4-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]phenyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)sulfonylphenyl]-4-(2-thienyl)butyramide Formula: C19H26N3O3S2+ MolecularWeight: 408.55804

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCC3=CC=CS3

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCCC3=CC=CS3

InChI

InChI=1S/C19H25N3O3S2/c1-21-11-13-22(14-12-21)27(24,25)18-9-7-16(8-10-18)20-19(23)6-2-4-17-5-3-15-26-17/h3,5,7-10,15H,2,4,6,11-14H2,1H3,(H,20,23)/p+1