tert-butyl 2-[2-(1-adamantylcarbonylimino)-4,5-dimethyl-1,3-thiazol-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[2-(1-adamantylcarbonylimino)-4,5-dimethyl-1,3-thiazol-3-yl]ethanoate Openeye Name: tert-butyl 2-[2-(adamantane-1-carbonylimino)-4,5-dimethyl-thiazol-3-yl]acetate CAS Name: 2-[2-[1-adamantyl(oxo)methyl]imino-4,5-dimethyl-3-thiazolyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-(adamantane-1-carbonylimino)-4,5-dimethyl-1,3-thiazol-3-yl]acetate Traditional Name: 2-[2-(adamantane-1-carbonylimino)-4,5-dimethyl-4-thiazolin-3-yl]acetic acid tert-butyl ester Formula: C22H32N2O3S MolecularWeight: 404.56608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=NC(=O)C23CC4CC(C2)CC(C4)C3)N1CC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(SC(=NC(=O)C23CC4CC(C2)CC(C4)C3)N1CC(=O)OC(C)(C)C)C

InChI

InChI=1S/C22H32N2O3S/c1-13-14(2)28-20(24(13)12-18(25)27-21(3,4)5)23-19(26)22-9-15-6-16(10-22)8-17(7-15)11-22/h15-17H,6-12H2,1-5H3