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

Systemtic Name: N-[[2-chloranyl-5-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]-piperonylamide Formula: C22H13Cl2N3O4S MolecularWeight: 486.32732

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=C(C=CC(=C3)C4=NC5=C(O4)C=CC(=C5)Cl)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=C(C=CC(=C3)C4=NC5=C(O4)C=CC(=C5)Cl)Cl

InChI

InChI=1S/C22H13Cl2N3O4S/c23-13-3-6-17-16(9-13)25-21(31-17)12-1-4-14(24)15(7-12)26-22(32)27-20(28)11-2-5-18-19(8-11)30-10-29-18/h1-9H,10H2,(H2,26,27,28,32)