ethyl 3-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1-benzofuran-5-yl]-2-(phenylmethylsulfanyl)propanoate

Systemtic Name: ethyl 3-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1-benzofuran-5-yl]-2-(phenylmethylsulfanyl)propanoate Openeye Name: ethyl 2-benzylsulfanyl-3-[2-[(5-methyl-2-phenyl-oxazol-4-yl)methyl]benzofuran-5-yl]propanoate CAS Name: 3-[2-[(5-methyl-2-phenyl-4-oxazolyl)methyl]-5-benzofuranyl]-2-(phenylmethylthio)propanoic acid ethyl ester IUPAC Name: ethyl 2-benzylsulfanyl-3-[2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-1-benzofuran-5-yl]propanoate Traditional Name: 2-(benzylthio)-3-[2-[(5-methyl-2-phenyl-oxazol-4-yl)methyl]benzofuran-5-yl]propionic acid ethyl ester Formula: C31H29NO4S MolecularWeight: 511.63126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC2=C(C=C1)OC(=C2)CC3=C(OC(=N3)C4=CC=CC=C4)C)SCC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C(CC1=CC2=C(C=C1)OC(=C2)CC3=C(OC(=N3)C4=CC=CC=C4)C)SCC5=CC=CC=C5

InChI

InChI=1S/C31H29NO4S/c1-3-34-31(33)29(37-20-22-10-6-4-7-11-22)17-23-14-15-28-25(16-23)18-26(36-28)19-27-21(2)35-30(32-27)24-12-8-5-9-13-24/h4-16,18,29H,3,17,19-20H2,1-2H3