3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[3-(2-thiophen-2-ylethynyl)phenyl]propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[3-[2-(2-thienyl)ethynyl]phenyl]propionamide Formula: C23H19NO3S MolecularWeight: 389.46686

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CCC(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CCC(=O)NC3=CC=CC(=C3)C#CC4=CC=CS4

InChI

InChI=1S/C23H19NO3S/c25-23(11-8-18-7-10-21-22(16-18)27-13-12-26-21)24-19-4-1-3-17(15-19)6-9-20-5-2-14-28-20/h1-5,7,10,14-16H,8,11-13H2,(H,24,25)