2-(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)-5-(2-nitrophenyl)-1,3,4-oxadiazole

Systemtic Name: 2-(5-chloranyl-2-methylsulfonyl-pyrimidin-4-yl)-5-(2-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-(5-chloro-2-methylsulfonyl-pyrimidin-4-yl)-5-(2-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-(5-chloro-2-methylsulfonyl-4-pyrimidinyl)-5-(2-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-(5-chloro-2-methylsulfonylpyrimidin-4-yl)-5-(2-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-(5-chloro-2-mesyl-pyrimidin-4-yl)-5-(2-nitrophenyl)-1,3,4-oxadiazole Formula: C13H8ClN5O5S MolecularWeight: 381.75112

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NC=C(C(=N1)C2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

CS(=O)(=O)C1=NC=C(C(=N1)C2=NN=C(O2)C3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C13H8ClN5O5S/c1-25(22,23)13-15-6-8(14)10(16-13)12-18-17-11(24-12)7-4-2-3-5-9(7)19(20)21/h2-6H,1H3