N-[1-[2-(1-adamantylcarbonyl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzenesulfonamide

Systemtic Name: N-[1-[2-(1-adamantylcarbonyl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzenesulfonamide Openeye Name: N-[1-[(adamantane-1-carbonylamino)carbamoyl]-3-methylsulfanyl-propyl]benzenesulfonamide CAS Name: N-[1-[[1-adamantyl(oxo)methyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]benzenesulfonamide IUPAC Name: N-[1-[2-(adamantane-1-carbonyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]benzenesulfonamide Traditional Name: N-[1-[(adamantane-1-carbonylamino)carbamoyl]-3-(methylthio)propyl]benzenesulfonamide Formula: C22H31N3O4S2 MolecularWeight: 465.62924

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NNC(=O)C12CC3CC(C1)CC(C3)C2)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CSCCC(C(=O)NNC(=O)C12CC3CC(C1)CC(C3)C2)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H31N3O4S2/c1-30-8-7-19(25-31(28,29)18-5-3-2-4-6-18)20(26)23-24-21(27)22-12-15-9-16(13-22)11-17(10-15)14-22/h2-6,15-17,19,25H,7-14H2,1H3,(H,23,26)(H,24,27)