5-bromanyl-N-[[4-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide

Systemtic Name: 5-bromanyl-N-[[4-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide Openeye Name: 5-bromo-N-[[4-(2-furylmethylcarbamoyl)phenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide CAS Name: 5-bromo-N-[[4-[(2-furanylmethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-(2-methoxyethoxy)benzamide IUPAC Name: 5-bromo-N-[[4-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-2-(2-methoxyethoxy)benzamide Traditional Name: 5-bromo-N-[[4-(2-furfurylcarbamoyl)phenyl]thiocarbamoyl]-2-(2-methoxyethoxy)benzamide Formula: C23H22BrN3O5S MolecularWeight: 532.40688

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CO3

Isomeric SMILES

COCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C23H22BrN3O5S/c1-30-11-12-32-20-9-6-16(24)13-19(20)22(29)27-23(33)26-17-7-4-15(5-8-17)21(28)25-14-18-3-2-10-31-18/h2-10,13H,11-12,14H2,1H3,(H,25,28)(H2,26,27,29,33)