2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-N-pentan-3-yl-benzamide

Systemtic Name: 2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-N-pentan-3-yl-benzamide Openeye Name: 2-[2-(1-adamantylamino)-2-oxo-ethyl]sulfanyl-N-(1-ethylpropyl)benzamide CAS Name: 2-[[2-(1-adamantylamino)-2-oxoethyl]thio]-N-pentan-3-ylbenzamide IUPAC Name: 2-[2-(1-adamantylamino)-2-oxoethyl]sulfanyl-N-pentan-3-ylbenzamide Traditional Name: 2-[[2-(1-adamantylamino)-2-keto-ethyl]thio]-N-(1-ethylpropyl)benzamide Formula: C24H34N2O2S MolecularWeight: 414.60396

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C1=CC=CC=C1SCC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCC(CC)NC(=O)C1=CC=CC=C1SCC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H34N2O2S/c1-3-19(4-2)25-23(28)20-7-5-6-8-21(20)29-15-22(27)26-24-12-16-9-17(13-24)11-18(10-16)14-24/h5-8,16-19H,3-4,9-15H2,1-2H3,(H,25,28)(H,26,27)