2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-ethanamide Openeye Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-(1,3-benzodioxol-5-ylmethyl)-N-ethyl-acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-(1,3-benzodioxol-5-ylmethyl)-N-ethylacetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-(1,3-benzodioxol-5-ylmethyl)-N-ethylacetamide Traditional Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-ethyl-N-piperonyl-acetamide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

InChI

InChI=1S/C19H17N5O3S/c1-2-24(9-12-3-4-15-16(5-12)27-11-26-15)17(25)10-28-19-14(8-21)6-13(7-20)18(22)23-19/h3-6H,2,9-11H2,1H3,(H2,22,23)