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

Systemtic Name: ethyl 2-[2-[2-(1-adamantyl)-2-oxidanylidene-ethyl]sulfanyl-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(1-adamantyl)-2-oxo-ethyl]sulfanylthiazol-4-yl]acetate CAS Name: 2-[2-[[2-(1-adamantyl)-2-oxoethyl]thio]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(1-adamantyl)-2-oxoethyl]sulfanyl-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[[2-(1-adamantyl)-2-keto-ethyl]thio]thiazol-4-yl]acetic acid ethyl ester Formula: C19H25NO3S2 MolecularWeight: 379.5367

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)SCC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)SCC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C19H25NO3S2/c1-2-23-17(22)6-15-10-24-18(20-15)25-11-16(21)19-7-12-3-13(8-19)5-14(4-12)9-19/h10,12-14H,2-9,11H2,1H3