4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 1-benzofuran-2-carboxylate

Systemtic Name: 4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 1-benzofuran-2-carboxylate Openeye Name: 4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid 4-(1,3-benzoxazol-2-ylthio)but-2-ynyl ester IUPAC Name: 4-(1,3-benzoxazol-2-ylsulfanyl)but-2-ynyl 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid 4-(1,3-benzoxazol-2-ylthio)but-2-ynyl ester Formula: C20H13NO4S MolecularWeight: 363.38652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)OCC#CCSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)OCC#CCSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C20H13NO4S/c22-19(18-13-14-7-1-3-9-16(14)24-18)23-11-5-6-12-26-20-21-15-8-2-4-10-17(15)25-20/h1-4,7-10,13H,11-12H2