5-[[4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methyl-imidazol-2-yl]amino]-3-methyl-imidazole-2,4-dione

Systemtic Name: 5-[[4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methyl-imidazol-2-yl]amino]-3-methyl-imidazole-2,4-dione Openeye Name: 5-[[4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methyl-imidazol-2-yl]amino]-3-methyl-imidazole-2,4-dione CAS Name: 5-[[4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methyl-2-imidazolyl]amino]-3-methylimidazole-2,4-dione IUPAC Name: 5-[[4,5-bis(1,3-benzodioxol-5-ylmethyl)-1-methylimidazol-2-yl]amino]-3-methylimidazole-2,4-dione Traditional Name: 3-methyl-5-[(1-methyl-4,5-dipiperonyl-imidazol-2-yl)amino]-3-imidazoline-2,4-quinone Formula: C24H21N5O6 MolecularWeight: 475.45344

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=C1NC2=NC(=O)N(C2=O)C)CC3=CC4=C(C=C3)OCO4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CN1C(=C(N=C1NC2=NC(=O)N(C2=O)C)CC3=CC4=C(C=C3)OCO4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C24H21N5O6/c1-28-16(8-14-4-6-18-20(10-14)35-12-33-18)15(7-13-3-5-17-19(9-13)34-11-32-17)25-23(28)26-21-22(30)29(2)24(31)27-21/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,25,26,27,31)