ethyl 2-[2-[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(1-adamantylmethylamino)-2-oxo-ethyl]sulfanylthiazol-4-yl]acetate CAS Name: 2-[2-[[2-(1-adamantylmethylamino)-2-oxoethyl]thio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(1-adamantylmethylamino)-2-oxoethyl]sulfanyl-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-(1-adamantylmethylamino)-2-keto-ethyl]thio]thiazol-4-yl]acetic acid ethyl ester Formula: C20H28N2O3S2 MolecularWeight: 408.57792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC(=O)NCC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC(=O)NCC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H28N2O3S2/c1-2-25-18(24)6-16-10-26-19(22-16)27-11-17(23)21-12-20-7-13-3-14(8-20)5-15(4-13)9-20/h10,13-15H,2-9,11-12H2,1H3,(H,21,23)