1-(4,6-dimethoxypyrimidin-2-yl)-3-[(5-nitro-2,3-dihydro-1H-inden-4-yl)sulfonyl]urea

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[(5-nitro-2,3-dihydro-1H-inden-4-yl)sulfonyl]urea Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(5-nitroindan-4-yl)sulfonyl-urea CAS Name: 1-(4,6-dimethoxy-2-pyrimidinyl)-3-[(5-nitro-2,3-dihydro-1H-inden-4-yl)sulfonyl]urea IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[(5-nitro-2,3-dihydro-1H-inden-4-yl)sulfonyl]urea Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(5-nitroindan-4-yl)sulfonyl-urea Formula: C16H17N5O7S MolecularWeight: 423.40048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC3=C2CCC3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(C=CC3=C2CCC3)[N+](=O)[O-])OC

InChI

InChI=1S/C16H17N5O7S/c1-27-12-8-13(28-2)18-15(17-12)19-16(22)20-29(25,26)14-10-5-3-4-9(10)6-7-11(14)21(23)24/h6-8H,3-5H2,1-2H3,(H2,17,18,19,20,22)