N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[(2-ethyl-6-methylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl]-piperonylamide Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NC(=O)C2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NC(=O)C2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C18H18N2O3S/c1-3-12-6-4-5-11(2)16(12)19-18(24)20-17(21)13-7-8-14-15(9-13)23-10-22-14/h4-9H,3,10H2,1-2H3,(H2,19,20,21,24)