5-bromanyl-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-bromanyl-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-[4-(4-propoxyphenyl)thiazol-2-yl]benzofuran-2-carboxamide CAS Name: 5-bromo-N-[4-(4-propoxyphenyl)-2-thiazolyl]-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-[4-(4-propoxyphenyl)-1,3-thiazol-2-yl]-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-[4-(4-propoxyphenyl)thiazol-2-yl]coumarilamide Formula: C21H17BrN2O3S MolecularWeight: 457.34028

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(O3)C=CC(=C4)Br

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=CC4=C(O3)C=CC(=C4)Br

InChI

InChI=1S/C21H17BrN2O3S/c1-2-9-26-16-6-3-13(4-7-16)17-12-28-21(23-17)24-20(25)19-11-14-10-15(22)5-8-18(14)27-19/h3-8,10-12H,2,9H2,1H3,(H,23,24,25)