5-methyl-4-(4-methylphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thiophene-3-carboxamide

Systemtic Name: 5-methyl-4-(4-methylphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thiophene-3-carboxamide Openeye Name: N-(1-isopropylpiperidin-1-ium-4-yl)-5-methyl-4-(p-tolyl)thiophene-3-carboxamide CAS Name: 5-methyl-4-(4-methylphenyl)-N-(1-propan-2-yl-4-piperidin-1-iumyl)-3-thiophenecarboxamide IUPAC Name: 5-methyl-4-(4-methylphenyl)-N-(1-propan-2-ylpiperidin-1-ium-4-yl)thiophene-3-carboxamide Traditional Name: N-(1-isopropylpiperidin-1-ium-4-yl)-5-methyl-4-(p-tolyl)thiophene-3-carboxamide Formula: C21H29N2OS+ MolecularWeight: 357.53276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC=C2C(=O)NC3CC[NH+](CC3)C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC=C2C(=O)NC3CC[NH+](CC3)C(C)C)C

InChI

InChI=1S/C21H28N2OS/c1-14(2)23-11-9-18(10-12-23)22-21(24)19-13-25-16(4)20(19)17-7-5-15(3)6-8-17/h5-8,13-14,18H,9-12H2,1-4H3,(H,22,24)/p+1