N-[2-(1-phenylpyrazol-4-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[2-(1-phenylpyrazol-4-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[2-(1-phenylpyrazol-4-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[2-(1-phenyl-4-pyrazolyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[2-(1-phenylpyrazol-4-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[2-(1-phenylpyrazol-4-yl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NCCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C19H19N3O4S/c23-27(24,17-6-7-18-19(12-17)26-11-10-25-18)21-9-8-15-13-20-22(14-15)16-4-2-1-3-5-16/h1-7,12-14,21H,8-11H2