1-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]urea

Systemtic Name: 1-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]urea Openeye Name: 1-[(2-morpholinopyridin-1-ium-3-yl)methyl]-3-[[2-(2-thienyl)oxazol-4-yl]methyl]urea CAS Name: 1-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-3-[(2-thiophen-2-yl-4-oxazolyl)methyl]urea IUPAC Name: 1-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]urea Traditional Name: 1-[(2-morpholinopyridin-1-ium-3-yl)methyl]-3-[[2-(2-thienyl)oxazol-4-yl]methyl]urea Formula: C19H22N5O3S+ MolecularWeight: 400.47468

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=CC=[NH+]2)CNC(=O)NCC3=COC(=N3)C4=CC=CS4

Isomeric SMILES

C1COCCN1C2=C(C=CC=[NH+]2)CNC(=O)NCC3=COC(=N3)C4=CC=CS4

InChI

InChI=1S/C19H21N5O3S/c25-19(22-12-15-13-27-18(23-15)16-4-2-10-28-16)21-11-14-3-1-5-20-17(14)24-6-8-26-9-7-24/h1-5,10,13H,6-9,11-12H2,(H2,21,22,25)/p+1