N-(furan-3-ylmethyl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(furan-3-ylmethyl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-(3-furylmethyl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-(3-furanylmethyl)-5-[(2R)-1-[3-(1-pyrazolyl)propyl]-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(furan-3-ylmethyl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-(3-furfuryl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C20H25N4O2S+ MolecularWeight: 385.5031

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CCCN2C=CC=N2)C3=CC=C(S3)C(=O)NCC4=COC=C4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CCCN2C=CC=N2)C3=CC=C(S3)C(=O)NCC4=COC=C4

InChI

InChI=1S/C20H24N4O2S/c25-20(21-14-16-7-13-26-15-16)19-6-5-18(27-19)17-4-1-9-23(17)10-3-12-24-11-2-8-22-24/h2,5-8,11,13,15,17H,1,3-4,9-10,12,14H2,(H,21,25)/p+1/t17-/m1/s1