N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(3,5-dichloro-4-hydroxy-phenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(3,5-dichloro-4-hydroxyanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(3,5-dichloro-4-hydroxy-phenyl)thiocarbamoyl]-piperonylamide Formula: C15H10Cl2N2O4S MolecularWeight: 385.2219

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C(=C3)Cl)O)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C(=C3)Cl)O)Cl

InChI

InChI=1S/C15H10Cl2N2O4S/c16-9-4-8(5-10(17)13(9)20)18-15(24)19-14(21)7-1-2-11-12(3-7)23-6-22-11/h1-5,20H,6H2,(H2,18,19,21,24)