N-[2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonylphenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonylphenyl]thiophene-2-carboxamide Openeye Name: N-[2-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-[oxo-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C23H29N4O3S+ MolecularWeight: 441.56636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3NC(=O)C4=CC=CS4

InChI

InChI=1S/C23H28N4O3S/c28-21(26-10-4-1-5-11-26)17-25-12-14-27(15-13-25)23(30)18-7-2-3-8-19(18)24-22(29)20-9-6-16-31-20/h2-3,6-9,16H,1,4-5,10-15,17H2,(H,24,29)/p+1