methyl (2S)-2-[[(2R)-2-(methylsulfonylamino)-3-thiophen-2-yl-propanoyl]amino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[[(2R)-2-(methylsulfonylamino)-3-thiophen-2-yl-propanoyl]amino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[(2R)-2-(methanesulfonamido)-3-(2-thienyl)propanoyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2R)-2-(methanesulfonamido)-1-oxo-3-thiophen-2-ylpropyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2R)-2-(methanesulfonamido)-3-thiophen-2-ylpropanoyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2R)-2-(methanesulfonamido)-3-(2-thienyl)propanoyl]amino]-3-phenyl-propionic acid methyl ester Formula: C18H22N2O5S2 MolecularWeight: 410.50768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=CS2)NS(=O)(=O)C

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC2=CC=CS2)NS(=O)(=O)C

InChI

InChI=1S/C18H22N2O5S2/c1-25-18(22)16(11-13-7-4-3-5-8-13)19-17(21)15(20-27(2,23)24)12-14-9-6-10-26-14/h3-10,15-16,20H,11-12H2,1-2H3,(H,19,21)/t15-,16+/m1/s1