(phenylmethyl) 1-[2-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]-2-oxidanyl-ethyl]indole-3-carboxylate

Systemtic Name: (phenylmethyl) 1-[2-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]-2-oxidanyl-ethyl]indole-3-carboxylate Openeye Name: benzyl 1-[2-[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]-2-hydroxy-ethyl]indole-3-carboxylate CAS Name: 1-[2-[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]-2-hydroxyethyl]-3-indolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[2-[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]-2-hydroxyethyl]indole-3-carboxylate Traditional Name: 1-[2-[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]-2-hydroxy-ethyl]indole-3-carboxylic acid benzyl ester Formula: C33H30N2O4S MolecularWeight: 550.6673

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)C(CN4C=C(C5=CC=CC=C54)C(=O)OCC6=CC=CC=C6)O

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)C(CN4C=C(C5=CC=CC=C54)C(=O)OCC6=CC=CC=C6)O

InChI

InChI=1S/C33H30N2O4S/c1-33(2,3)30-20-40-31(34-30)29-16-23-15-22(13-14-28(23)39-29)27(36)18-35-17-25(24-11-7-8-12-26(24)35)32(37)38-19-21-9-5-4-6-10-21/h4-17,20,27,36H,18-19H2,1-3H3