2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]ethanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-pyridin-2-yl)sulfanyl-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]ethanamide Openeye Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)sulfanyl]-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide CAS Name: 2-[(6-amino-3,5-dicyano-2-pyridinyl)thio]-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide IUPAC Name: 2-(6-amino-3,5-dicyanopyridin-2-yl)sulfanyl-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide Traditional Name: 2-[(6-amino-3,5-dicyano-2-pyridyl)thio]-N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]acetamide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

Isomeric SMILES

C[C@H](C1=CC2=C(C=C1)OCCO2)NC(=O)CSC3=C(C=C(C(=N3)N)C#N)C#N

InChI

InChI=1S/C19H17N5O3S/c1-11(12-2-3-15-16(7-12)27-5-4-26-15)23-17(25)10-28-19-14(9-21)6-13(8-20)18(22)24-19/h2-3,6-7,11H,4-5,10H2,1H3,(H2,22,24)(H,23,25)/t11-/m1/s1