N-(2,4-dimethyl-6-oxidanylidene-pyridin-1-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide

Systemtic Name: N-(2,4-dimethyl-6-oxidanylidene-pyridin-1-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Openeye Name: N-(2,4-dimethyl-6-oxo-1-pyridyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide CAS Name: N-(2,4-dimethyl-6-oxo-1-pyridinyl)-5-[(2R)-2-pyrrolidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(2,4-dimethyl-6-oxopyridin-1-yl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Traditional Name: N-(2-keto-4,6-dimethyl-1-pyridyl)-5-[(2R)-pyrrolidin-1-ium-2-yl]thiophene-2-carboxamide Formula: C16H20N3O2S+ MolecularWeight: 318.4139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O2S/c1-10-8-11(2)19(15(20)9-10)18-16(21)14-6-5-13(22-14)12-4-3-7-17-12/h5-6,8-9,12,17H,3-4,7H2,1-2H3,(H,18,21)/p+1/t12-/m1/s1