N-[2-[2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]hydrazinyl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoyl]hydrazinyl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[2-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]hydrazo]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[2-[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]hydrazinyl]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[N'-[2-(1,3-benzothiazol-2-ylthio)acetyl]hydrazino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NNC(=O)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCC(=O)NNC(=O)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H26N4O3S2/c27-18(11-23-20(29)22-8-13-5-14(9-22)7-15(6-13)10-22)25-26-19(28)12-30-21-24-16-3-1-2-4-17(16)31-21/h1-4,13-15H,5-12H2,(H,23,29)(H,25,27)(H,26,28)