N-[4-(ethanoylcarbamothioylamino)phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[4-(ethanoylcarbamothioylamino)phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[4-(acetylcarbamothioylamino)phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[4-[[acetamido(sulfanylidene)methyl]amino]phenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[4-(acetylcarbamothioylamino)phenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[4-(acetylthiocarbamoylamino)phenyl]-piperonylamide Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H15N3O4S/c1-10(21)18-17(25)20-13-5-3-12(4-6-13)19-16(22)11-2-7-14-15(8-11)24-9-23-14/h2-8H,9H2,1H3,(H,19,22)(H2,18,20,21,25)