[2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]ethanoate

Systemtic Name: [2-(1-adamantylamino)-2-oxidanylidene-ethyl] 2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]ethanoate Openeye Name: [2-(1-adamantylamino)-2-oxo-ethyl] 2-[2-(m-tolyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-methylphenyl)-4-thiazolyl]acetic acid [2-(1-adamantylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylamino)-2-oxoethyl] 2-[2-(3-methylphenyl)-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-(m-tolyl)thiazol-4-yl]acetic acid [2-(1-adamantylamino)-2-keto-ethyl] ester Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=CS2)CC(=O)OCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H28N2O3S/c1-15-3-2-4-19(5-15)23-25-20(14-30-23)9-22(28)29-13-21(27)26-24-10-16-6-17(11-24)8-18(7-16)12-24/h2-5,14,16-18H,6-13H2,1H3,(H,26,27)