(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate

Systemtic Name: (5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Openeye Name: [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propanoic acid (5-methyl-2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-acetamido-3-(1H-indol-3-yl)propionic acid [5-methyl-2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CS2)COC(=O)C(CC3=CNC4=CC=CC=C43)NC(=O)C

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CS2)COC(=O)[C@H](CC3=CNC4=CC=CC=C43)NC(=O)C

InChI

InChI=1S/C22H21N3O4S/c1-13-19(25-21(29-13)20-8-5-9-30-20)12-28-22(27)18(24-14(2)26)10-15-11-23-17-7-4-3-6-16(15)17/h3-9,11,18,23H,10,12H2,1-2H3,(H,24,26)/t18-/m0/s1