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

Systemtic Name: 5-bromanyl-N-[[4-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide Openeye Name: 5-bromo-N-[[4-(2-furylmethylcarbamoyl)phenyl]carbamothioyl]-2-phenethyloxy-benzamide CAS Name: 5-bromo-N-[[4-[(2-furanylmethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-phenethyloxybenzamide IUPAC Name: 5-bromo-N-[[4-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]-2-phenethyloxybenzamide Traditional Name: 5-bromo-N-[[4-(2-furfurylcarbamoyl)phenyl]thiocarbamoyl]-2-phenethyloxy-benzamide Formula: C28H24BrN3O4S MolecularWeight: 578.47686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NC3=CC=C(C=C3)C(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)Br)C(=O)NC(=S)NC3=CC=C(C=C3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C28H24BrN3O4S/c29-21-10-13-25(36-16-14-19-5-2-1-3-6-19)24(17-21)27(34)32-28(37)31-22-11-8-20(9-12-22)26(33)30-18-23-7-4-15-35-23/h1-13,15,17H,14,16,18H2,(H,30,33)(H2,31,32,34,37)