methyl (2S)-2-[2-[2-(furan-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[2-[2-(furan-2-ylcarbonylamino)-1,3-thiazol-4-yl]ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-[2-(furan-2-carbonylamino)thiazol-4-yl]acetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[2-[2-[[2-furanyl(oxo)methyl]amino]-4-thiazolyl]-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-[2-(furan-2-carbonylamino)-1,3-thiazol-4-yl]acetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-[2-(2-furoylamino)thiazol-4-yl]acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=CO3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CC2=CSC(=N2)NC(=O)C3=CC=CO3

InChI

InChI=1S/C20H19N3O5S/c1-27-19(26)15(10-13-6-3-2-4-7-13)22-17(24)11-14-12-29-20(21-14)23-18(25)16-8-5-9-28-16/h2-9,12,15H,10-11H2,1H3,(H,22,24)(H,21,23,25)/t15-/m0/s1