N-[(2R)-2-[3-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]propyl]furan-3-carboxamide

Systemtic Name: N-[(2R)-2-[3-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]propyl]furan-3-carboxamide Openeye Name: N-[(2R)-2-[3-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]propyl]furan-3-carboxamide CAS Name: N-[(2R)-2-[3-(4-thiomorpholin-4-iumylmethyl)phenoxy]propyl]-3-furancarboxamide IUPAC Name: N-[(2R)-2-[3-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]propyl]furan-3-carboxamide Traditional Name: N-[(2R)-2-[3-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]propyl]-3-furamide Formula: C19H25N2O3S+ MolecularWeight: 361.4784

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=COC=C1)OC2=CC=CC(=C2)C[NH+]3CCSCC3

Isomeric SMILES

C[C@H](CNC(=O)C1=COC=C1)OC2=CC=CC(=C2)C[NH+]3CCSCC3

InChI

InChI=1S/C19H24N2O3S/c1-15(12-20-19(22)17-5-8-23-14-17)24-18-4-2-3-16(11-18)13-21-6-9-25-10-7-21/h2-5,8,11,14-15H,6-7,9-10,12-13H2,1H3,(H,20,22)/p+1/t15-/m1/s1