4-tert-butyl-N-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-N-ethyl-3-nitro-benzamide

Systemtic Name: 4-tert-butyl-N-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)sulfonyl-N-ethyl-3-nitro-benzamide Openeye Name: 4-tert-butyl-N-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-N-ethyl-3-nitro-benzamide CAS Name: 4-tert-butyl-N-[(5-chloro-1,3-dimethyl-4-pyrazolyl)sulfonyl]-N-ethyl-3-nitrobenzamide IUPAC Name: 4-tert-butyl-N-(5-chloro-1,3-dimethylpyrazol-4-yl)sulfonyl-N-ethyl-3-nitrobenzamide Traditional Name: 4-tert-butyl-N-(5-chloro-1,3-dimethyl-pyrazol-4-yl)sulfonyl-N-ethyl-3-nitro-benzamide Formula: C18H23ClN4O5S MolecularWeight: 442.91702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC(=C(C=C1)C(C)(C)C)[N+](=O)[O-])S(=O)(=O)C2=C(N(N=C2C)C)Cl

Isomeric SMILES

CCN(C(=O)C1=CC(=C(C=C1)C(C)(C)C)[N+](=O)[O-])S(=O)(=O)C2=C(N(N=C2C)C)Cl

InChI

InChI=1S/C18H23ClN4O5S/c1-7-22(29(27,28)15-11(2)20-21(6)16(15)19)17(24)12-8-9-13(18(3,4)5)14(10-12)23(25)26/h8-10H,7H2,1-6H3