(phenylmethyl) 4-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-sulfanylidene-butanoate

Systemtic Name: (phenylmethyl) 4-azanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-sulfanylidene-butanoate Openeye Name: benzyl 4-amino-3-(tert-butoxycarbonylamino)-4-thioxo-butanoate CAS Name: 4-amino-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-sulfanylidenebutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-amino-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-sulfanylidenebutanoate Traditional Name: 4-amino-3-(tert-butoxycarbonylamino)-4-thioxo-butyric acid benzyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=S)N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)OCC1=CC=CC=C1)C(=S)N

InChI

InChI=1S/C16H22N2O4S/c1-16(2,3)22-15(20)18-12(14(17)23)9-13(19)21-10-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3,(H2,17,23)(H,18,20)