methyl (2S)-3-phenyl-2-[3-(thiophen-3-ylcarbonylamino)propanoylamino]propanoate

Systemtic Name: methyl (2S)-3-phenyl-2-[3-(thiophen-3-ylcarbonylamino)propanoylamino]propanoate Openeye Name: methyl (2S)-3-phenyl-2-[3-(thiophene-3-carbonylamino)propanoylamino]propanoate CAS Name: (2S)-2-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-3-phenyl-2-[3-(thiophene-3-carbonylamino)propanoylamino]propanoate Traditional Name: (2S)-3-phenyl-2-[3-(3-thenoylamino)propanoylamino]propionic acid methyl ester Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CCNC(=O)C2=CSC=C2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CCNC(=O)C2=CSC=C2

InChI

InChI=1S/C18H20N2O4S/c1-24-18(23)15(11-13-5-3-2-4-6-13)20-16(21)7-9-19-17(22)14-8-10-25-12-14/h2-6,8,10,12,15H,7,9,11H2,1H3,(H,19,22)(H,20,21)/t15-/m0/s1