[2-[(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(1-adamantyl)ethanoate

Systemtic Name: [2-[(4-methyl-2-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(1-adamantyl)ethanoate Openeye Name: [2-(4-methyl-2-morpholinosulfonyl-anilino)-2-oxo-ethyl] 2-(1-adamantyl)acetate CAS Name: 2-(1-adamantyl)acetic acid [2-[4-methyl-2-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-2-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-(1-adamantyl)acetate Traditional Name: 2-(1-adamantyl)acetic acid [2-keto-2-(4-methyl-2-morpholinosulfonyl-anilino)ethyl] ester Formula: C25H34N2O6S MolecularWeight: 490.61226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)CC23CC4CC(C2)CC(C4)C3)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)CC23CC4CC(C2)CC(C4)C3)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C25H34N2O6S/c1-17-2-3-21(22(8-17)34(30,31)27-4-6-32-7-5-27)26-23(28)16-33-24(29)15-25-12-18-9-19(13-25)11-20(10-18)14-25/h2-3,8,18-20H,4-7,9-16H2,1H3,(H,26,28)