5-bromanyl-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiophene-2-sulfonamide Openeye Name: 5-bromo-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]thiophene-2-sulfonamide CAS Name: 5-bromo-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-2-thiophenesulfonamide IUPAC Name: 5-bromo-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethylpyrazol-4-yl]thiophene-2-sulfonamide Traditional Name: 5-bromo-N-(1-m-anisyl-3,5-dimethyl-pyrazol-4-yl)thiophene-2-sulfonamide Formula: C17H18BrN3O3S2 MolecularWeight: 456.37712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)OC)C)NS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)OC)C)NS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H18BrN3O3S2/c1-11-17(20-26(22,23)16-8-7-15(18)25-16)12(2)21(19-11)10-13-5-4-6-14(9-13)24-3/h4-9,20H,10H2,1-3H3