N-[4,5-dimethyl-3-[(S)-(4-methylpiperidin-1-ium-1-yl)-phenyl-methyl]thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperidin-1-ium-1-yl)-phenyl-methyl]thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperidin-1-ium-1-yl)-phenyl-methyl]-2-thienyl]furan-2-carboxamide CAS Name: N-[4,5-dimethyl-3-[(S)-(4-methyl-1-piperidin-1-iumyl)-phenylmethyl]-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperidin-1-ium-1-yl)-phenylmethyl]thiophen-2-yl]furan-2-carboxamide Traditional Name: N-[4,5-dimethyl-3-[(S)-(4-methylpiperidin-1-ium-1-yl)-phenyl-methyl]-2-thienyl]-2-furamide Formula: C24H29N2O2S+ MolecularWeight: 409.56426

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)C(C2=CC=CC=C2)C3=C(SC(=C3C)C)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1CC[NH+](CC1)[C@@H](C2=CC=CC=C2)C3=C(SC(=C3C)C)NC(=O)C4=CC=CO4

InChI

InChI=1S/C24H28N2O2S/c1-16-11-13-26(14-12-16)22(19-8-5-4-6-9-19)21-17(2)18(3)29-24(21)25-23(27)20-10-7-15-28-20/h4-10,15-16,22H,11-14H2,1-3H3,(H,25,27)/p+1/t22-/m0/s1