tert-butyl 2-[(4-methylphenyl)methylamino]-3-sulfanyl-propanoate

Systemtic Name: tert-butyl 2-[(4-methylphenyl)methylamino]-3-sulfanyl-propanoate Openeye Name: tert-butyl 2-(p-tolylmethylamino)-3-sulfanyl-propanoate CAS Name: 3-mercapto-2-[(4-methylphenyl)methylamino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(4-methylphenyl)methylamino]-3-sulfanylpropanoate Traditional Name: 3-mercapto-2-[(4-methylbenzyl)amino]propionic acid tert-butyl ester Formula: C15H23NO2S MolecularWeight: 281.41362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(CS)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNC(CS)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H23NO2S/c1-11-5-7-12(8-6-11)9-16-13(10-19)14(17)18-15(2,3)4/h5-8,13,16,19H,9-10H2,1-4H3