N-(4-butanoylphenyl)-5-chloranyl-1,3-dimethyl-pyrazole-4-sulfonamide

Systemtic Name: N-(4-butanoylphenyl)-5-chloranyl-1,3-dimethyl-pyrazole-4-sulfonamide Openeye Name: N-(4-butanoylphenyl)-5-chloro-1,3-dimethyl-pyrazole-4-sulfonamide CAS Name: 5-chloro-1,3-dimethyl-N-[4-(1-oxobutyl)phenyl]-4-pyrazolesulfonamide IUPAC Name: N-(4-butanoylphenyl)-5-chloro-1,3-dimethylpyrazole-4-sulfonamide Traditional Name: N-(4-butyrylphenyl)-5-chloro-1,3-dimethyl-pyrazole-4-sulfonamide Formula: C15H18ClN3O3S MolecularWeight: 355.83972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(N(N=C2C)C)Cl

Isomeric SMILES

CCCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(N(N=C2C)C)Cl

InChI

InChI=1S/C15H18ClN3O3S/c1-4-5-13(20)11-6-8-12(9-7-11)18-23(21,22)14-10(2)17-19(3)15(14)16/h6-9,18H,4-5H2,1-3H3