2-(1-adamantyl)-N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxidanylidene-ethyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxidanylidene-ethyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxo-ethyl]acetamide CAS Name: 2-(1-adamantyl)-N-[2-[2-[(2-cyanophenyl)methylthio]ethylamino]-2-oxoethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[2-[2-[(2-cyanophenyl)methylsulfanyl]ethylamino]-2-oxoethyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[2-[2-[(2-cyanobenzyl)thio]ethylamino]-2-keto-ethyl]acetamide Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NCC(=O)NCCSCC4=CC=CC=C4C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NCC(=O)NCCSCC4=CC=CC=C4C#N

InChI

InChI=1S/C24H31N3O2S/c25-14-20-3-1-2-4-21(20)16-30-6-5-26-23(29)15-27-22(28)13-24-10-17-7-18(11-24)9-19(8-17)12-24/h1-4,17-19H,5-13,15-16H2,(H,26,29)(H,27,28)