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

Systemtic Name: tert-butyl 2-[(4-methoxyphenyl)methylcarbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate Openeye Name: tert-butyl 3-tert-butoxy-2-[(4-methoxyphenyl)methylcarbamothioylamino]propanoate CAS Name: 2-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-methoxyphenyl)methylcarbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate Traditional Name: 3-tert-butoxy-2-(p-anisylthiocarbamoylamino)propionic acid tert-butyl ester Formula: C20H32N2O4S MolecularWeight: 396.54408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OCC(C(=O)OC(C)(C)C)NC(=S)NCC1=CC=C(C=C1)OC

Isomeric SMILES

CC(C)(C)OCC(C(=O)OC(C)(C)C)NC(=S)NCC1=CC=C(C=C1)OC

InChI

InChI=1S/C20H32N2O4S/c1-19(2,3)25-13-16(17(23)26-20(4,5)6)22-18(27)21-12-14-8-10-15(24-7)11-9-14/h8-11,16H,12-13H2,1-7H3,(H2,21,22,27)