3-(3-cyano-6-phenyl-pyridin-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide

Systemtic Name: 3-(3-cyano-6-phenyl-pyridin-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Openeye Name: 3-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide CAS Name: 3-[(3-cyano-6-phenyl-2-pyridinyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide IUPAC Name: 3-(3-cyano-6-phenylpyridin-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide Traditional Name: 3-[(3-cyano-6-phenyl-2-pyridyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propionamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CCSC3=C(C=CC(=N3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CCSC3=C(C=CC(=N3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C23H19N3O3S/c24-15-17-6-8-19(16-4-2-1-3-5-16)26-23(17)30-13-10-22(27)25-18-7-9-20-21(14-18)29-12-11-28-20/h1-9,14H,10-13H2,(H,25,27)