5-bromanyl-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-methyl-N-[[1-(phenylmethyl)pyrazol-4-yl]methyl]thiophene-2-sulfonamide Openeye Name: N-[(1-benzylpyrazol-4-yl)methyl]-5-bromo-N-methyl-thiophene-2-sulfonamide CAS Name: 5-bromo-N-methyl-N-[[1-(phenylmethyl)-4-pyrazolyl]methyl]-2-thiophenesulfonamide IUPAC Name: N-[(1-benzylpyrazol-4-yl)methyl]-5-bromo-N-methylthiophene-2-sulfonamide Traditional Name: N-[(1-benzylpyrazol-4-yl)methyl]-5-bromo-N-methyl-thiophene-2-sulfonamide Formula: C16H16BrN3O2S2 MolecularWeight: 426.35114

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CN(CC1=CN(N=C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H16BrN3O2S2/c1-19(24(21,22)16-8-7-15(17)23-16)10-14-9-18-20(12-14)11-13-5-3-2-4-6-13/h2-9,12H,10-11H2,1H3