1-[4-(2-methoxyethylsulfanyl)-6-methyl-pyrimidin-2-yl]-1-methyl-3-(2-nitrophenyl)sulfonyl-urea

Systemtic Name: 1-[4-(2-methoxyethylsulfanyl)-6-methyl-pyrimidin-2-yl]-1-methyl-3-(2-nitrophenyl)sulfonyl-urea Openeye Name: 1-[4-(2-methoxyethylsulfanyl)-6-methyl-pyrimidin-2-yl]-1-methyl-3-(2-nitrophenyl)sulfonyl-urea CAS Name: 1-[4-(2-methoxyethylthio)-6-methyl-2-pyrimidinyl]-1-methyl-3-(2-nitrophenyl)sulfonylurea IUPAC Name: 1-[4-(2-methoxyethylsulfanyl)-6-methylpyrimidin-2-yl]-1-methyl-3-(2-nitrophenyl)sulfonylurea Traditional Name: 1-[4-(2-methoxyethylthio)-6-methyl-pyrimidin-2-yl]-1-methyl-3-(2-nitrophenyl)sulfonyl-urea Formula: C16H19N5O6S2 MolecularWeight: 441.48196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])SCCOC

Isomeric SMILES

CC1=CC(=NC(=N1)N(C)C(=O)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])SCCOC

InChI

InChI=1S/C16H19N5O6S2/c1-11-10-14(28-9-8-27-3)18-15(17-11)20(2)16(22)19-29(25,26)13-7-5-4-6-12(13)21(23)24/h4-7,10H,8-9H2,1-3H3,(H,19,22)