N-[(4-ethylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(4-ethylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(4-ethylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(4-ethylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(4-ethylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(4-ethylphenyl)thiocarbamoyl]-piperonylamide Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H16N2O3S/c1-2-11-3-6-13(7-4-11)18-17(23)19-16(20)12-5-8-14-15(9-12)22-10-21-14/h3-9H,2,10H2,1H3,(H2,18,19,20,23)