tert-butyl 2-[1-[[3-(4-carbamothioylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]carbonyl]piperidin-4-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[1-[[3-(4-carbamothioylphenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]carbonyl]piperidin-4-yl]oxyethanoate Openeye Name: tert-butyl 2-[[1-[3-(4-carbamothioylphenyl)-2-oxo-oxazolidine-5-carbonyl]-4-piperidyl]oxy]acetate CAS Name: 2-[[1-[[3-(4-carbamothioylphenyl)-2-oxo-5-oxazolidinyl]-oxomethyl]-4-piperidinyl]oxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-[3-(4-carbamothioylphenyl)-2-oxo-1,3-oxazolidine-5-carbonyl]piperidin-4-yl]oxyacetate Traditional Name: 2-[[1-[2-keto-3-(4-thiocarbamoylphenyl)oxazolidine-5-carbonyl]-4-piperidyl]oxy]acetic acid tert-butyl ester Formula: C22H29N3O6S MolecularWeight: 463.54716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1CCN(CC1)C(=O)C2CN(C(=O)O2)C3=CC=C(C=C3)C(=S)N

Isomeric SMILES

CC(C)(C)OC(=O)COC1CCN(CC1)C(=O)C2CN(C(=O)O2)C3=CC=C(C=C3)C(=S)N

InChI

InChI=1S/C22H29N3O6S/c1-22(2,3)31-18(26)13-29-16-8-10-24(11-9-16)20(27)17-12-25(21(28)30-17)15-6-4-14(5-7-15)19(23)32/h4-7,16-17H,8-13H2,1-3H3,(H2,23,32)