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

Systemtic Name: N-[1-[2-(1-adamantylcarbonyl)hydrazinyl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-chloranyl-benzamide Openeye Name: N-[1-[(adamantane-1-carbonylamino)carbamoyl]-3-methylsulfanyl-propyl]-2-chloro-benzamide CAS Name: N-[1-[[1-adamantyl(oxo)methyl]hydrazo]-4-(methylthio)-1-oxobutan-2-yl]-2-chlorobenzamide IUPAC Name: N-[1-[2-(adamantane-1-carbonyl)hydrazinyl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-chlorobenzamide Traditional Name: N-[1-[(adamantane-1-carbonylamino)carbamoyl]-3-(methylthio)propyl]-2-chloro-benzamide Formula: C23H30ClN3O3S MolecularWeight: 464.0206

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NNC(=O)C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=CC=C4Cl

Isomeric SMILES

CSCCC(C(=O)NNC(=O)C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H30ClN3O3S/c1-31-7-6-19(25-20(28)17-4-2-3-5-18(17)24)21(29)26-27-22(30)23-11-14-8-15(12-23)10-16(9-14)13-23/h2-5,14-16,19H,6-13H2,1H3,(H,25,28)(H,26,29)(H,27,30)