2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-N-cyclohexyl-benzamide

Systemtic Name: 2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfanyl-N-cyclohexyl-benzamide Openeye Name: 2-[2-(1-adamantylamino)-2-oxo-ethyl]sulfanyl-N-cyclohexyl-benzamide CAS Name: 2-[[2-(1-adamantylamino)-2-oxoethyl]thio]-N-cyclohexylbenzamide IUPAC Name: 2-[2-(1-adamantylamino)-2-oxoethyl]sulfanyl-N-cyclohexylbenzamide Traditional Name: 2-[[2-(1-adamantylamino)-2-keto-ethyl]thio]-N-cyclohexyl-benzamide Formula: C25H34N2O2S MolecularWeight: 426.61466

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC=CC=C2SCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC=CC=C2SCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H34N2O2S/c28-23(27-25-13-17-10-18(14-25)12-19(11-17)15-25)16-30-22-9-5-4-8-21(22)24(29)26-20-6-2-1-3-7-20/h4-5,8-9,17-20H,1-3,6-7,10-16H2,(H,26,29)(H,27,28)