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

Systemtic Name: 5-bromanyl-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-[4-(4-ethylphenyl)thiazol-2-yl]-3-methyl-benzofuran-2-carboxamide CAS Name: 5-bromo-N-[4-(4-ethylphenyl)-2-thiazolyl]-3-methyl-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-[4-(4-ethylphenyl)thiazol-2-yl]-3-methyl-coumarilamide Formula: C21H17BrN2O2S MolecularWeight: 441.34088

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C4=C(O3)C=CC(=C4)Br)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C4=C(O3)C=CC(=C4)Br)C

InChI

InChI=1S/C21H17BrN2O2S/c1-3-13-4-6-14(7-5-13)17-11-27-21(23-17)24-20(25)19-12(2)16-10-15(22)8-9-18(16)26-19/h4-11H,3H2,1-2H3,(H,23,24,25)