N-(3-methyl-1,2-thiazol-5-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(3-methyl-1,2-thiazol-5-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-(3-methylisothiazol-5-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-(3-methyl-5-isothiazolyl)-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(3-methyl-1,2-thiazol-5-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-(3-methylisothiazol-5-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C13H16N3OS2+ MolecularWeight: 294.41564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1)NC(=O)C2=CC=C(S2)C3CCC[NH2+]3

Isomeric SMILES

CC1=NSC(=C1)NC(=O)C2=CC=C(S2)[C@H]3CCC[NH2+]3

InChI

InChI=1S/C13H15N3OS2/c1-8-7-12(19-16-8)15-13(17)11-5-4-10(18-11)9-3-2-6-14-9/h4-5,7,9,14H,2-3,6H2,1H3,(H,15,17)/p+1/t9-/m1/s1