2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(4-phenylphenyl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(4-phenylphenyl)methylsulfanyl]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[(4-phenylphenyl)methylsulfanyl]propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[(4-phenylphenyl)methylthio]propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[(4-phenylphenyl)methylsulfanyl]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[(4-phenylbenzyl)thio]propionic acid Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSCC1=CC=C(C=C1)C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H25NO4S/c1-21(2,3)26-20(25)22-18(19(23)24)14-27-13-15-9-11-17(12-10-15)16-7-5-4-6-8-16/h4-12,18H,13-14H2,1-3H3,(H,22,25)(H,23,24)