tert-butyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate

Systemtic Name: tert-butyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate Openeye Name: tert-butyl 3-tert-butoxy-2-[(2,5-dimethoxyphenyl)carbamothioylamino]propanoate CAS Name: 2-[[(2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2,5-dimethoxyphenyl)carbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate Traditional Name: 3-tert-butoxy-2-[(2,5-dimethoxyphenyl)thiocarbamoylamino]propionic acid tert-butyl ester Formula: C20H32N2O5S MolecularWeight: 412.54348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OCC(C(=O)OC(C)(C)C)NC(=S)NC1=C(C=CC(=C1)OC)OC

Isomeric SMILES

CC(C)(C)OCC(C(=O)OC(C)(C)C)NC(=S)NC1=C(C=CC(=C1)OC)OC

InChI

InChI=1S/C20H32N2O5S/c1-19(2,3)26-12-15(17(23)27-20(4,5)6)22-18(28)21-14-11-13(24-7)9-10-16(14)25-8/h9-11,15H,12H2,1-8H3,(H2,21,22,28)