N-(3-aminocarbonyl-6-propan-2-yl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-5-methyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-(3-aminocarbonyl-6-propan-2-yl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-5-methyl-1,2-oxazole-3-carboxamide Openeye Name: N-(3-carbamoyl-6-isopropyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-5-methyl-isoxazole-3-carboxamide CAS Name: N-(3-carbamoyl-6-propan-2-yl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-5-methyl-3-isoxazolecarboxamide IUPAC Name: N-(3-carbamoyl-6-propan-2-yl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-5-methyl-1,2-oxazole-3-carboxamide Traditional Name: N-(3-carbamoyl-6-isopropyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium-2-yl)-5-methyl-isoxazole-3-carboxamide Formula: C16H21N4O3S+ MolecularWeight: 349.42794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NC2=C(C3=C(S2)C[NH+](CC3)C(C)C)C(=O)N

Isomeric SMILES

CC1=CC(=NO1)C(=O)NC2=C(C3=C(S2)C[NH+](CC3)C(C)C)C(=O)N

InChI

InChI=1S/C16H20N4O3S/c1-8(2)20-5-4-10-12(7-20)24-16(13(10)14(17)21)18-15(22)11-6-9(3)23-19-11/h6,8H,4-5,7H2,1-3H3,(H2,17,21)(H,18,22)/p+1