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

Systemtic Name: N-[4-oxidanylidene-4-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]butyl]thiophene-2-carboxamide Openeye Name: N-[4-oxo-4-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-yl]butyl]thiophene-2-carboxamide CAS Name: N-[4-oxo-4-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]butyl]-2-thiophenecarboxamide IUPAC Name: N-[4-oxo-4-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-yl]butyl]thiophene-2-carboxamide Traditional Name: N-[4-keto-4-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-yl]butyl]thiophene-2-carboxamide Formula: C20H31N4O3S+ MolecularWeight: 407.55014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)CCCNC(=O)C3=CC=CS3

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)CCCNC(=O)C3=CC=CS3

InChI

InChI=1S/C20H30N4O3S/c25-18(7-4-8-21-20(27)17-6-5-15-28-17)24-13-11-22(12-14-24)16-19(26)23-9-2-1-3-10-23/h5-6,15H,1-4,7-14,16H2,(H,21,27)/p+1