ethyl 2-[2-[2-(3-bromanyl-1-adamantyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(3-bromanyl-1-adamantyl)ethanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[[2-(3-bromo-1-adamantyl)acetyl]amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[2-(3-bromo-1-adamantyl)-1-oxoethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[[2-(3-bromo-1-adamantyl)acetyl]amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-(3-bromo-1-adamantyl)acetyl]amino]thiazol-4-yl]acetic acid ethyl ester Formula: C19H25BrN2O3S MolecularWeight: 441.3824

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

InChI

InChI=1S/C19H25BrN2O3S/c1-2-25-16(24)4-14-10-26-17(21-14)22-15(23)9-18-5-12-3-13(6-18)8-19(20,7-12)11-18/h10,12-13H,2-9,11H2,1H3,(H,21,22,23)