N-[[2-(2-bromanyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-5-chloranyl-naphthalene-1-carboxamide

Systemtic Name: N-[[2-(2-bromanyl-5-iodanyl-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-5-chloranyl-naphthalene-1-carboxamide Openeye Name: N-[[2-(2-bromo-5-iodo-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-5-chloro-naphthalene-1-carboxamide CAS Name: N-[[[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-5-chloro-1-naphthalenecarboxamide IUPAC Name: N-[[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-5-chloronaphthalene-1-carboxamide Traditional Name: N-[[2-(2-bromo-5-iodo-phenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-5-chloro-1-naphthamide Formula: C25H14BrClIN3O2S MolecularWeight: 662.72403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)I)Br

Isomeric SMILES

C1=CC2=C(C=CC=C2Cl)C(=C1)C(=O)NC(=S)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=CC(=C5)I)Br

InChI

InChI=1S/C25H14BrClIN3O2S/c26-19-9-7-13(28)11-18(19)24-30-21-12-14(8-10-22(21)33-24)29-25(34)31-23(32)17-5-1-4-16-15(17)3-2-6-20(16)27/h1-12H,(H2,29,31,32,34)