tert-butyl 2-[4-[(5-carbamothioylfuro[2,3-b]pyridin-2-yl)carbonylamino]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[4-[(5-carbamothioylfuro[2,3-b]pyridin-2-yl)carbonylamino]phenoxy]ethanoate Openeye Name: tert-butyl 2-[4-[(5-carbamothioylfuro[2,3-b]pyridine-2-carbonyl)amino]phenoxy]acetate CAS Name: 2-[4-[[(5-carbamothioyl-2-furo[2,3-b]pyridinyl)-oxomethyl]amino]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(5-carbamothioylfuro[2,3-b]pyridine-2-carbonyl)amino]phenoxy]acetate Traditional Name: 2-[4-[(5-thiocarbamoylfuro[2,3-b]pyridine-2-carbonyl)amino]phenoxy]acetic acid tert-butyl ester Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1=CC=C(C=C1)NC(=O)C2=CC3=CC(=CN=C3O2)C(=S)N

Isomeric SMILES

CC(C)(C)OC(=O)COC1=CC=C(C=C1)NC(=O)C2=CC3=CC(=CN=C3O2)C(=S)N

InChI

InChI=1S/C21H21N3O5S/c1-21(2,3)29-17(25)11-27-15-6-4-14(5-7-15)24-19(26)16-9-12-8-13(18(22)30)10-23-20(12)28-16/h4-10H,11H2,1-3H3,(H2,22,30)(H,24,26)