5-methyl-N-phenyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]thiophene-2-carboxamide

Systemtic Name: 5-methyl-N-phenyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]thiophene-2-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-methyl-N-phenyl-thiophene-2-carboxamide CAS Name: 5-methyl-N-phenyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-methyl-N-phenylthiophene-2-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-5-methyl-N-phenyl-thiophene-2-carboxamide Formula: C24H27N2OS+ MolecularWeight: 391.54898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)N(C2CC[NH+](CC2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(S1)C(=O)N(C2CC[NH+](CC2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2OS/c1-19-12-13-23(28-19)24(27)26(21-10-6-3-7-11-21)22-14-16-25(17-15-22)18-20-8-4-2-5-9-20/h2-13,22H,14-18H2,1H3/p+1