N-cyclopropyl-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonyl-thiophene-3-sulfonamide

Systemtic Name: N-cyclopropyl-2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]carbonyl-thiophene-3-sulfonamide Openeye Name: N-cyclopropyl-2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-carbonyl]thiophene-3-sulfonamide CAS Name: N-cyclopropyl-2-[oxo-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]methyl]-3-thiophenesulfonamide IUPAC Name: N-cyclopropyl-2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-carbonyl]thiophene-3-sulfonamide Traditional Name: N-cyclopropyl-2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-carbonyl]thiophene-3-sulfonamide Formula: C18H27N4O4S2+ MolecularWeight: 427.56138

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C=CS3)S(=O)(=O)NC4CC4

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=C(C=CS3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C18H26N4O4S2/c23-16(21-6-1-2-7-21)13-20-8-10-22(11-9-20)18(24)17-15(5-12-27-17)28(25,26)19-14-3-4-14/h5,12,14,19H,1-4,6-11,13H2/p+1