N-[3-(pyrazol-1-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[3-(pyrazol-1-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[3-(pyrazol-1-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[3-(1-pyrazolylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[3-(pyrazol-1-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[3-(pyrazol-1-ylmethyl)phenyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC(=C3)CN4C=CC=N4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)S(=O)(=O)NC3=CC=CC(=C3)CN4C=CC=N4

InChI

InChI=1S/C18H17N3O4S/c22-26(23,16-5-6-17-18(12-16)25-10-9-24-17)20-15-4-1-3-14(11-15)13-21-8-2-7-19-21/h1-8,11-12,20H,9-10,13H2