N-[4-[2-(4-phenylpiperazin-1-ium-1-yl)ethylcarbamoyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[2-(4-phenylpiperazin-1-ium-1-yl)ethylcarbamoyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[2-(4-phenylpiperazin-1-ium-1-yl)ethylcarbamoyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[oxo-[2-(4-phenyl-1-piperazin-1-iumyl)ethylamino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[2-(4-phenylpiperazin-1-ium-1-yl)ethylcarbamoyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[2-(4-phenylpiperazin-1-ium-1-yl)ethylcarbamoyl]phenyl]thiophene-2-carboxamide Formula: C24H27N4O2S+ MolecularWeight: 435.56178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N4O2S/c29-23(19-8-10-20(11-9-19)26-24(30)22-7-4-18-31-22)25-12-13-27-14-16-28(17-15-27)21-5-2-1-3-6-21/h1-11,18H,12-17H2,(H,25,29)(H,26,30)/p+1