(5-chloranyl-2-nitro-phenyl)-(2-methylsulfanyl-5,6-dihydro-4H-pyrimidin-1-yl)methanone

Systemtic Name: (5-chloranyl-2-nitro-phenyl)-(2-methylsulfanyl-5,6-dihydro-4H-pyrimidin-1-yl)methanone Openeye Name: (5-chloro-2-nitro-phenyl)-(2-methylsulfanyl-5,6-dihydro-4H-pyrimidin-1-yl)methanone CAS Name: (5-chloro-2-nitrophenyl)-[2-(methylthio)-5,6-dihydro-4H-pyrimidin-1-yl]methanone IUPAC Name: (5-chloro-2-nitrophenyl)-(2-methylsulfanyl-5,6-dihydro-4H-pyrimidin-1-yl)methanone Traditional Name: (5-chloro-2-nitro-phenyl)-[2-(methylthio)-5,6-dihydro-4H-pyrimidin-1-yl]methanone Formula: C12H12ClN3O3S MolecularWeight: 313.75998

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NCCCN1C(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CSC1=NCCCN1C(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClN3O3S/c1-20-12-14-5-2-6-15(12)11(17)9-7-8(13)3-4-10(9)16(18)19/h3-4,7H,2,5-6H2,1H3