2-[(4-methylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-sulfanyl-butanoic acid

Systemtic Name: 2-[(4-methylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-sulfanyl-butanoic acid Openeye Name: 2-[tert-butoxycarbonyl(p-tolylmethyl)amino]-3-sulfanyl-butanoic acid CAS Name: 3-mercapto-2-[(4-methylphenyl)methyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(4-methylphenyl)methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-sulfanylbutanoic acid Traditional Name: 2-[tert-butoxycarbonyl-(4-methylbenzyl)amino]-3-mercapto-butyric acid Formula: C17H25NO4S MolecularWeight: 339.4497

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C(C(C)S)C(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C(C(C)S)C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H25NO4S/c1-11-6-8-13(9-7-11)10-18(14(12(2)23)15(19)20)16(21)22-17(3,4)5/h6-9,12,14,23H,10H2,1-5H3,(H,19,20)