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

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C20H28N4OS+2 MolecularWeight: 372.52752

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(S3)C4CCC[NH2+]4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC=C(S3)[C@H]4CCC[NH2+]4

InChI

InChI=1S/C20H26N4OS/c1-23-11-13-24(14-12-23)17-7-3-2-5-15(17)22-20(25)19-9-8-18(26-19)16-6-4-10-21-16/h2-3,5,7-9,16,21H,4,6,10-14H2,1H3,(H,22,25)/p+2/t16-/m1/s1