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1,3-dithian-2-ylmethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate

1,3-dithian-2-ylmethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate

Systemtic Name:1,3-dithian-2-ylmethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenyl-propanoate
Openeye Name:1,3-dithian-2-ylmethyl (2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propanoate
CAS Name:(2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-phenylpropanoic acid 1,3-dithian-2-ylmethyl ester
IUPAC Name:1,3-dithian-2-ylmethyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate
Traditional Name:(2S)-2-(tert-butoxycarbonylamino)-3-phenyl-propionic acid 1,3-dithian-2-ylmethyl ester
Formula: C19H27NO4S2
MolecularWeight: 397.55198
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)OCC2SCCCS2


Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OCC2SCCCS2


InChI

InChI=1S/C19H27NO4S2/c1-19(2,3)24-18(22)20-15(12-14-8-5-4-6-9-14)17(21)23-13-16-25-10-7-11-26-16/h4-6,8-9,15-16H,7,10-13H2,1-3H3,(H,20,22)/t15-/m0/s1


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