S-(4-methylphenyl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanethioate

Systemtic Name: S-(4-methylphenyl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanethioate Openeye Name: S-(p-tolyl) 2-(tert-butoxycarbonylamino)-3-methyl-butanethioate CAS Name: 3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanethioic acid S-(4-methylphenyl) ester IUPAC Name: S-(4-methylphenyl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanethioate Traditional Name: 2-(tert-butoxycarbonylamino)-3-methyl-butanethioic acid S-(p-tolyl) ester Formula: C17H25NO3S MolecularWeight: 323.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=O)C(C(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(=O)C(C(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H25NO3S/c1-11(2)14(18-16(20)21-17(4,5)6)15(19)22-13-9-7-12(3)8-10-13/h7-11,14H,1-6H3,(H,18,20)