N-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(2-keto-1,3-dihydrobenzimidazol-5-yl)thiocarbamoyl]-piperonylamide Formula: C16H12N4O4S MolecularWeight: 356.35588

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)NC(=O)N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC4=C(C=C3)NC(=O)N4

InChI

InChI=1S/C16H12N4O4S/c21-14(8-1-4-12-13(5-8)24-7-23-12)20-16(25)17-9-2-3-10-11(6-9)19-15(22)18-10/h1-6H,7H2,(H2,18,19,22)(H2,17,20,21,25)