N-[4,5-dimethoxy-2-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]carbonyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4,5-dimethoxy-2-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]carbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[4,5-dimethoxy-2-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4,5-dimethoxy-2-[oxo-[4-[[(2R)-2-oxolanyl]methyl]-1-piperazin-4-iumyl]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4,5-dimethoxy-2-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4,5-dimethoxy-2-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C23H30N3O5S+ MolecularWeight: 460.5664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CC[NH+](CC2)CC3CCCO3)NC(=O)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CC[NH+](CC2)C[C@H]3CCCO3)NC(=O)C4=CC=CS4)OC

InChI

InChI=1S/C23H29N3O5S/c1-29-19-13-17(18(14-20(19)30-2)24-22(27)21-6-4-12-32-21)23(28)26-9-7-25(8-10-26)15-16-5-3-11-31-16/h4,6,12-14,16H,3,5,7-11,15H2,1-2H3,(H,24,27)/p+1/t16-/m1/s1