N-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]butane-1-sulfonamide

Systemtic Name: N-[4-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)phenyl]butane-1-sulfonamide Openeye Name: N-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]butane-1-sulfonamide CAS Name: N-[4-(4-bromo-3,5-dimethyl-1-pyrazolyl)phenyl]-1-butanesulfonamide IUPAC Name: N-[4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]butane-1-sulfonamide Traditional Name: N-[4-(4-bromo-3,5-dimethyl-pyrazol-1-yl)phenyl]butane-1-sulfonamide Formula: C15H20BrN3O2S MolecularWeight: 386.3072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=CC=C(C=C1)N2C(=C(C(=N2)C)Br)C

Isomeric SMILES

CCCCS(=O)(=O)NC1=CC=C(C=C1)N2C(=C(C(=N2)C)Br)C

InChI

InChI=1S/C15H20BrN3O2S/c1-4-5-10-22(20,21)18-13-6-8-14(9-7-13)19-12(3)15(16)11(2)17-19/h6-9,18H,4-5,10H2,1-3H3