N-(3-methylbutyl)-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]adamantane-1-carboxamide

Systemtic Name: N-(3-methylbutyl)-N-[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl]adamantane-1-carboxamide Openeye Name: N-isopentyl-N-[2-oxo-2-(thiazol-2-ylamino)ethyl]adamantane-1-carboxamide CAS Name: N-(3-methylbutyl)-N-[2-oxo-2-(2-thiazolylamino)ethyl]-1-adamantanecarboxamide IUPAC Name: N-(3-methylbutyl)-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]adamantane-1-carboxamide Traditional Name: N-isoamyl-N-[2-keto-2-(thiazol-2-ylamino)ethyl]adamantane-1-carboxamide Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(=O)NC1=NC=CS1)C(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)CCN(CC(=O)NC1=NC=CS1)C(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H31N3O2S/c1-14(2)3-5-24(13-18(25)23-20-22-4-6-27-20)19(26)21-10-15-7-16(11-21)9-17(8-15)12-21/h4,6,14-17H,3,5,7-13H2,1-2H3,(H,22,23,25)