N-[(pyrazin-2-ylcarbonylamino)carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(pyrazin-2-ylcarbonylamino)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(pyrazine-2-carbonylamino)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[[[oxo(2-pyrazinyl)methyl]hydrazo]-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(pyrazine-2-carbonylamino)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(pyrazinoylamino)thiocarbamoyl]-piperonylamide Formula: C14H11N5O4S MolecularWeight: 345.33324

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NNC(=O)C3=NC=CN=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NNC(=O)C3=NC=CN=C3

InChI

InChI=1S/C14H11N5O4S/c20-12(8-1-2-10-11(5-8)23-7-22-10)17-14(24)19-18-13(21)9-6-15-3-4-16-9/h1-6H,7H2,(H,18,21)(H2,17,19,20,24)