2-(1-adamantyl)-N'-[2-[(4-cyanophenyl)methylsulfanyl]ethanoyl]ethanehydrazide

Systemtic Name: 2-(1-adamantyl)-N'-[2-[(4-cyanophenyl)methylsulfanyl]ethanoyl]ethanehydrazide Openeye Name: 2-(1-adamantyl)-N'-[2-[(4-cyanophenyl)methylsulfanyl]acetyl]acetohydrazide CAS Name: 2-(1-adamantyl)-N'-[2-[(4-cyanophenyl)methylthio]-1-oxoethyl]acetohydrazide IUPAC Name: 2-(1-adamantyl)-N'-[2-[(4-cyanophenyl)methylsulfanyl]acetyl]acetohydrazide Traditional Name: 2-(1-adamantyl)-N'-[2-[(4-cyanobenzyl)thio]acetyl]acetohydrazide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NNC(=O)CSCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NNC(=O)CSCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H27N3O2S/c23-12-15-1-3-16(4-2-15)13-28-14-21(27)25-24-20(26)11-22-8-17-5-18(9-22)7-19(6-17)10-22/h1-4,17-19H,5-11,13-14H2,(H,24,26)(H,25,27)