N-[2-(3-bromanyl-4-methoxy-phenyl)ethyl]-5-chloranyl-1,3-dimethyl-pyrazole-4-sulfonamide

Systemtic Name: N-[2-(3-bromanyl-4-methoxy-phenyl)ethyl]-5-chloranyl-1,3-dimethyl-pyrazole-4-sulfonamide Openeye Name: N-[2-(3-bromo-4-methoxy-phenyl)ethyl]-5-chloro-1,3-dimethyl-pyrazole-4-sulfonamide CAS Name: N-[2-(3-bromo-4-methoxyphenyl)ethyl]-5-chloro-1,3-dimethyl-4-pyrazolesulfonamide IUPAC Name: N-[2-(3-bromo-4-methoxyphenyl)ethyl]-5-chloro-1,3-dimethylpyrazole-4-sulfonamide Traditional Name: N-[2-(3-bromo-4-methoxy-phenyl)ethyl]-5-chloro-1,3-dimethyl-pyrazole-4-sulfonamide Formula: C14H17BrClN3O3S MolecularWeight: 422.72508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1S(=O)(=O)NCCC2=CC(=C(C=C2)OC)Br)Cl)C

Isomeric SMILES

CC1=NN(C(=C1S(=O)(=O)NCCC2=CC(=C(C=C2)OC)Br)Cl)C

InChI

InChI=1S/C14H17BrClN3O3S/c1-9-13(14(16)19(2)18-9)23(20,21)17-7-6-10-4-5-12(22-3)11(15)8-10/h4-5,8,17H,6-7H2,1-3H3