1-[(1-methylindol-3-yl)carbonylamino]-3-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]urea

Systemtic Name: 1-[(1-methylindol-3-yl)carbonylamino]-3-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]urea Openeye Name: 1-[(1-methylindole-3-carbonyl)amino]-3-[(2-morpholinopyridin-1-ium-3-yl)methyl]urea CAS Name: 1-[[(1-methyl-3-indolyl)-oxomethyl]amino]-3-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]urea IUPAC Name: 1-[(1-methylindole-3-carbonyl)amino]-3-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]urea Traditional Name: 1-[(1-methylindole-3-carbonyl)amino]-3-[(2-morpholinopyridin-1-ium-3-yl)methyl]urea Formula: C21H25N6O3+ MolecularWeight: 409.4616

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(=O)NNC(=O)NCC3=C([NH+]=CC=C3)N4CCOCC4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(=O)NNC(=O)NCC3=C([NH+]=CC=C3)N4CCOCC4

InChI

InChI=1S/C21H24N6O3/c1-26-14-17(16-6-2-3-7-18(16)26)20(28)24-25-21(29)23-13-15-5-4-8-22-19(15)27-9-11-30-12-10-27/h2-8,14H,9-13H2,1H3,(H,24,28)(H2,23,25,29)/p+1