3-[3-(6-chloranyl-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxyphenyl]-N,N-dimethyl-propanamide

Systemtic Name: 3-[3-(6-chloranyl-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxyphenyl]-N,N-dimethyl-propanamide Openeye Name: 3-[3-(6-chloro-2-methylsulfanyl-5-nitro-pyrimidin-4-yl)oxyphenyl]-N,N-dimethyl-propanamide CAS Name: 3-[3-[[6-chloro-2-(methylthio)-5-nitro-4-pyrimidinyl]oxy]phenyl]-N,N-dimethylpropanamide IUPAC Name: 3-[3-(6-chloro-2-methylsulfanyl-5-nitropyrimidin-4-yl)oxyphenyl]-N,N-dimethylpropanamide Traditional Name: 3-[3-[6-chloro-2-(methylthio)-5-nitro-pyrimidin-4-yl]oxyphenyl]-N,N-dimethyl-propionamide Formula: C16H17ClN4O4S MolecularWeight: 396.84858

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCC1=CC(=CC=C1)OC2=C(C(=NC(=N2)SC)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CCC1=CC(=CC=C1)OC2=C(C(=NC(=N2)SC)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN4O4S/c1-20(2)12(22)8-7-10-5-4-6-11(9-10)25-15-13(21(23)24)14(17)18-16(19-15)26-3/h4-6,9H,7-8H2,1-3H3