1-[3-(6-chloranyl-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxyphenyl]urea

Systemtic Name: 1-[3-(6-chloranyl-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxyphenyl]urea Openeye Name: [3-(6-chloro-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxyphenyl]urea CAS Name: [3-[[6-chloro-2-(methylthio)-5-nitro-4-pyrimidinyl]oxy]phenyl]urea IUPAC Name: [3-(6-chloro-2-methylsulfanyl-5-nitropyrimidin-4-yl)oxyphenyl]urea Traditional Name: [3-[6-chloro-2-(methylthio)-5-nitro-pyrimidin-4-yl]oxyphenyl]urea Formula: C12H10ClN5O4S MolecularWeight: 355.7569

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])OC2=CC=CC(=C2)NC(=O)N

Isomeric SMILES

CSC1=NC(=C(C(=N1)Cl)[N+](=O)[O-])OC2=CC=CC(=C2)NC(=O)N

InChI

InChI=1S/C12H10ClN5O4S/c1-23-12-16-9(13)8(18(20)21)10(17-12)22-7-4-2-3-6(5-7)15-11(14)19/h2-5H,1H3,(H3,14,15,19)