tert-butyl 2-[(4-methoxyphenyl)carbonylcarbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate

Systemtic Name: tert-butyl 2-[(4-methoxyphenyl)carbonylcarbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate Openeye Name: tert-butyl 3-tert-butoxy-2-[(4-methoxybenzoyl)carbamothioylamino]propanoate CAS Name: 2-[[[[(4-methoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-methoxybenzoyl)carbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate Traditional Name: 3-tert-butoxy-2-(p-anisoylthiocarbamoylamino)propionic acid tert-butyl ester Formula: C20H30N2O5S MolecularWeight: 410.5276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O5S/c1-19(2,3)26-12-15(17(24)27-20(4,5)6)21-18(28)22-16(23)13-8-10-14(25-7)11-9-13/h8-11,15H,12H2,1-7H3,(H2,21,22,23,28)