2-chloranyl-N-[[2-(3-chloranyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-5-iodanyl-benzamide

Systemtic Name: 2-chloranyl-N-[[2-(3-chloranyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-5-iodanyl-benzamide Openeye Name: 2-chloro-N-[[2-(3-chloro-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-5-iodo-benzamide CAS Name: 2-chloro-N-[[[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]-5-iodobenzamide IUPAC Name: 2-chloro-N-[[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-5-iodobenzamide Traditional Name: 2-chloro-N-[[2-(3-chloro-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]thiocarbamoyl]-5-iodo-benzamide Formula: C22H14Cl2IN3O3S MolecularWeight: 598.24033

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=C(C=CC(=C4)I)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=C(C=CC(=C4)I)Cl)Cl

InChI

InChI=1S/C22H14Cl2IN3O3S/c1-30-18-6-2-11(8-16(18)24)21-27-17-10-13(4-7-19(17)31-21)26-22(32)28-20(29)14-9-12(25)3-5-15(14)23/h2-10H,1H3,(H2,26,28,29,32)