tert-butyl 2-[(4-tert-butylphenyl)carbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate

Systemtic Name: tert-butyl 2-[(4-tert-butylphenyl)carbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate Openeye Name: tert-butyl 3-tert-butoxy-2-[(4-tert-butylphenyl)carbamothioylamino]propanoate CAS Name: 2-[[(4-tert-butylanilino)-sulfanylidenemethyl]amino]-3-[(2-methylpropan-2-yl)oxy]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-tert-butylphenyl)carbamothioylamino]-3-[(2-methylpropan-2-yl)oxy]propanoate Traditional Name: 3-tert-butoxy-2-[(4-tert-butylphenyl)thiocarbamoylamino]propionic acid tert-butyl ester Formula: C22H36N2O3S MolecularWeight: 408.59784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36N2O3S/c1-20(2,3)15-10-12-16(13-11-15)23-19(28)24-17(14-26-21(4,5)6)18(25)27-22(7,8)9/h10-13,17H,14H2,1-9H3,(H2,23,24,28)