N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide

Systemtic Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-N-[4-(p-tolyl)thiazol-2-yl]furan-2-carboxamide CAS Name: N-[4-(4-methylphenyl)-2-thiazolyl]-N-[3-(4-morpholin-4-iumyl)propyl]-2-furancarboxamide IUPAC Name: N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-N-(3-morpholin-4-ium-4-ylpropyl)furan-2-carboxamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-N-[4-(p-tolyl)thiazol-2-yl]-2-furamide Formula: C22H26N3O3S+ MolecularWeight: 412.52514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)N(CCC[NH+]3CCOCC3)C(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)N(CCC[NH+]3CCOCC3)C(=O)C4=CC=CO4

InChI

InChI=1S/C22H25N3O3S/c1-17-5-7-18(8-6-17)19-16-29-22(23-19)25(21(26)20-4-2-13-28-20)10-3-9-24-11-14-27-15-12-24/h2,4-8,13,16H,3,9-12,14-15H2,1H3/p+1