N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-piperonylamide Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C#N)C

InChI

InChI=1S/C19H19N3O4S/c1-4-22(5-2)19(24)16-11(3)13(9-20)18(27-16)21-17(23)12-6-7-14-15(8-12)26-10-25-14/h6-8H,4-5,10H2,1-3H3,(H,21,23)