2-[[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-ethyl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[[2-(1-adamantylamino)-2-oxidanylidene-ethyl]-ethyl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[[2-(1-adamantylamino)-2-oxo-ethyl]-ethyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[2-(1-adamantylamino)-2-oxoethyl]-ethylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[[2-(1-adamantylamino)-2-oxoethyl]-ethylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[[2-(1-adamantylamino)-2-keto-ethyl]-ethyl-amino]-N-(2-thenyl)acetamide Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=CS1)CC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCN(CC(=O)NCC1=CC=CS1)CC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H31N3O2S/c1-2-24(13-19(25)22-12-18-4-3-5-27-18)14-20(26)23-21-9-15-6-16(10-21)8-17(7-15)11-21/h3-5,15-17H,2,6-14H2,1H3,(H,22,25)(H,23,26)