methyl 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-3-cyano-indole-5-carboxylate

Systemtic Name: methyl 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-3-cyano-indole-5-carboxylate Openeye Name: methyl 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]-3-cyano-indole-5-carboxylate CAS Name: 1-[[2-(4-tert-butyl-2-thiazolyl)-5-benzofuranyl]methyl]-3-cyano-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-(4-tert-butyl-1,3-thiazol-2-yl)-1-benzofuran-5-yl]methyl]-3-cyanoindole-5-carboxylate Traditional Name: 1-[[2-(4-tert-butylthiazol-2-yl)benzofuran-5-yl]methyl]-3-cyano-indole-5-carboxylic acid methyl ester Formula: C27H23N3O3S MolecularWeight: 469.55482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C=C(C5=C4C=CC(=C5)C(=O)OC)C#N

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)C2=CC3=C(O2)C=CC(=C3)CN4C=C(C5=C4C=CC(=C5)C(=O)OC)C#N

InChI

InChI=1S/C27H23N3O3S/c1-27(2,3)24-15-34-25(29-24)23-11-18-9-16(5-8-22(18)33-23)13-30-14-19(12-28)20-10-17(26(31)32-4)6-7-21(20)30/h5-11,14-15H,13H2,1-4H3