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

Systemtic Name: N-[(2-methoxydibenzofuran-3-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(2-methoxydibenzofuran-3-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[(2-methoxy-3-dibenzofuranyl)amino]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(2-methoxydibenzofuran-3-yl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(2-methoxydibenzofuran-3-yl)thiocarbamoyl]-piperonylamide Formula: C22H16N2O5S MolecularWeight: 420.43784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=S)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=C(C=C2C(=C1)C3=CC=CC=C3O2)NC(=S)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H16N2O5S/c1-26-19-9-14-13-4-2-3-5-16(13)29-18(14)10-15(19)23-22(30)24-21(25)12-6-7-17-20(8-12)28-11-27-17/h2-10H,11H2,1H3,(H2,23,24,25,30)