4-methyl-5-phenyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thiophene-2-carboxamide

Systemtic Name: 4-methyl-5-phenyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thiophene-2-carboxamide Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-4-methyl-5-phenyl-thiophene-2-carboxamide CAS Name: 4-methyl-5-phenyl-N-(1-propan-2-yl-4-piperidin-1-iumyl)-2-thiophenecarboxamide IUPAC Name: 4-methyl-5-phenyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thiophene-2-carboxamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-4-methyl-5-phenyl-thiophene-2-carboxamide Formula: C20H27N2OS+ MolecularWeight: 343.50618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(=O)NC2CC[NH+](CC2)C(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1)C(=O)NC2CC[NH+](CC2)C(C)C)C3=CC=CC=C3

InChI

InChI=1S/C20H26N2OS/c1-14(2)22-11-9-17(10-12-22)21-20(23)18-13-15(3)19(24-18)16-7-5-4-6-8-16/h4-8,13-14,17H,9-12H2,1-3H3,(H,21,23)/p+1