methyl (2S)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfinyl-butanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfinyl-butanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[(2R)-2-(tert-butoxycarbonylamino)-4-methylsulfinyl-butanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-methylsulfinyl-1-oxobutyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfinylbutanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2R)-2-(tert-butoxycarbonylamino)-4-methylsulfinyl-butanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H30N2O6S MolecularWeight: 426.527

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O6S/c1-20(2,3)28-19(25)22-15(11-12-29(5)26)17(23)21-16(18(24)27-4)13-14-9-7-6-8-10-14/h6-10,15-16H,11-13H2,1-5H3,(H,21,23)(H,22,25)/t15-,16+,29?/m1/s1