ethyl 5-[(4-tert-butylphenyl)sulfonyl-pyridin-4-yl-amino]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(4-tert-butylphenyl)sulfonyl-pyridin-4-yl-amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(4-tert-butylphenyl)sulfonyl-(4-pyridyl)amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[(4-tert-butylphenyl)sulfonyl-pyridin-4-ylamino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-tert-butylphenyl)sulfonyl-pyridin-4-ylamino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-tert-butylphenyl)sulfonyl-(4-pyridyl)amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C32H30N2O5S MolecularWeight: 554.656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C3=CC=NC=C3)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C3=CC=NC=C3)S(=O)(=O)C4=CC=C(C=C4)C(C)(C)C)C5=CC=CC=C5

InChI

InChI=1S/C32H30N2O5S/c1-5-38-31(35)29-27-21-25(13-16-28(27)39-30(29)22-9-7-6-8-10-22)34(24-17-19-33-20-18-24)40(36,37)26-14-11-23(12-15-26)32(2,3)4/h6-21H,5H2,1-4H3