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

Systemtic Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-1-[3-(1-pyrazolyl)propyl]-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-(1H-imidazol-2-ylmethyl)-5-[(2R)-1-(3-pyrazol-1-ylpropyl)pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C19H25N6OS+ MolecularWeight: 385.5064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC([NH+](C1)CCCN2C=CC=N2)C3=CC=C(S3)C(=O)NCC4=NC=CN4

Isomeric SMILES

C1C[C@@H]([NH+](C1)CCCN2C=CC=N2)C3=CC=C(S3)C(=O)NCC4=NC=CN4

InChI

InChI=1S/C19H24N6OS/c26-19(22-14-18-20-8-9-21-18)17-6-5-16(27-17)15-4-1-10-24(15)11-3-13-25-12-2-7-23-25/h2,5-9,12,15H,1,3-4,10-11,13-14H2,(H,20,21)(H,22,26)/p+1/t15-/m1/s1