N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]benzohydrazide

Systemtic Name: N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)ethanoyl]benzohydrazide Openeye Name: N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]benzohydrazide CAS Name: N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)-1-oxoethyl]benzohydrazide IUPAC Name: N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]benzohydrazide Traditional Name: N'-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylthio)acetyl]benzohydrazide Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)SCC(=O)NNC(=O)C3=CC=CC=C3)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)SCC(=O)NNC(=O)C3=CC=CC=C3)OC1

InChI

InChI=1S/C18H18N2O4S/c21-17(19-20-18(22)13-5-2-1-3-6-13)12-25-14-7-8-15-16(11-14)24-10-4-9-23-15/h1-3,5-8,11H,4,9-10,12H2,(H,19,21)(H,20,22)