N-(1-adamantyl)-2-[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(1-adamantyl)-2-[2-(cyclohexylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: N-(1-adamantyl)-2-[2-(cyclohexylmethylamino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: N-(1-adamantyl)-2-[[2-(cyclohexylmethylamino)-2-oxoethyl]thio]benzamide IUPAC Name: N-(1-adamantyl)-2-[2-(cyclohexylmethylamino)-2-oxoethyl]sulfanylbenzamide Traditional Name: N-(1-adamantyl)-2-[[2-(cyclohexylmethylamino)-2-keto-ethyl]thio]benzamide Formula: C26H36N2O2S MolecularWeight: 440.64124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)CSC2=CC=CC=C2C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCC(CC1)CNC(=O)CSC2=CC=CC=C2C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H36N2O2S/c29-24(27-16-18-6-2-1-3-7-18)17-31-23-9-5-4-8-22(23)25(30)28-26-13-19-10-20(14-26)12-21(11-19)15-26/h4-5,8-9,18-21H,1-3,6-7,10-17H2,(H,27,29)(H,28,30)