N'-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoyl]-2-pyrrol-1-yl-benzohydrazide

Systemtic Name: N'-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoyl]-2-pyrrol-1-yl-benzohydrazide Openeye Name: N'-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]-2-pyrrol-1-yl-benzohydrazide CAS Name: N'-[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]-2-(1-pyrrolyl)benzohydrazide IUPAC Name: N'-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]-2-pyrrol-1-ylbenzohydrazide Traditional Name: N'-[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]-2-pyrrol-1-yl-benzohydrazide Formula: C21H19N3O4S MolecularWeight: 409.45826

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC(=O)NNC(=O)C3=CC=CC=C3N4C=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC(=O)NNC(=O)C3=CC=CC=C3N4C=CC=C4

InChI

InChI=1S/C21H19N3O4S/c25-20(14-29-15-7-8-18-19(13-15)28-12-11-27-18)22-23-21(26)16-5-1-2-6-17(16)24-9-3-4-10-24/h1-10,13H,11-12,14H2,(H,22,25)(H,23,26)