2-chloranyl-N-[3-methylsulfanyl-4-(4-nitrophenyl)-1H-pyrazol-5-yl]ethanamide

Systemtic Name: 2-chloranyl-N-[3-methylsulfanyl-4-(4-nitrophenyl)-1H-pyrazol-5-yl]ethanamide Openeye Name: 2-chloro-N-[3-methylsulfanyl-4-(4-nitrophenyl)-1H-pyrazol-5-yl]acetamide CAS Name: 2-chloro-N-[3-(methylthio)-4-(4-nitrophenyl)-1H-pyrazol-5-yl]acetamide IUPAC Name: 2-chloro-N-[3-methylsulfanyl-4-(4-nitrophenyl)-1H-pyrazol-5-yl]acetamide Traditional Name: 2-chloro-N-[3-(methylthio)-4-(4-nitrophenyl)-1H-pyrazol-5-yl]acetamide Formula: C12H11ClN4O3S MolecularWeight: 326.75874

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=C1C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CCl

Isomeric SMILES

CSC1=NNC(=C1C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CCl

InChI

InChI=1S/C12H11ClN4O3S/c1-21-12-10(11(15-16-12)14-9(18)6-13)7-2-4-8(5-3-7)17(19)20/h2-5H,6H2,1H3,(H2,14,15,16,18)