N-[(2R)-3-methyl-1-oxidanylidene-1-[(1-propan-2-ylpiperidin-1-ium-4-yl)amino]butan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2R)-3-methyl-1-oxidanylidene-1-[(1-propan-2-ylpiperidin-1-ium-4-yl)amino]butan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1R)-1-[(1-isopropylpiperidin-1-ium-4-yl)carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide CAS Name: N-[(2R)-3-methyl-1-oxo-1-[(1-propan-2-yl-4-piperidin-1-iumyl)amino]butan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2R)-3-methyl-1-oxo-1-[(1-propan-2-ylpiperidin-1-ium-4-yl)amino]butan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1R)-1-[(1-isopropylpiperidin-1-ium-4-yl)carbamoyl]-2-methyl-propyl]thiophene-2-carboxamide Formula: C18H30N3O2S+ MolecularWeight: 352.5147

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CC[NH+](CC1)C(C)C)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@H](C(=O)NC1CC[NH+](CC1)C(C)C)NC(=O)C2=CC=CS2

InChI

InChI=1S/C18H29N3O2S/c1-12(2)16(20-17(22)15-6-5-11-24-15)18(23)19-14-7-9-21(10-8-14)13(3)4/h5-6,11-14,16H,7-10H2,1-4H3,(H,19,23)(H,20,22)/p+1/t16-/m1/s1