3-phenyl-N-[(5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]prop-2-ynamide

Systemtic Name: 3-phenyl-N-[(5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]prop-2-ynamide Openeye Name: 3-phenyl-N-[(5-pyrazin-2-yl-2,3-dihydrobenzofuran-2-yl)methyl]prop-2-ynamide CAS Name: 3-phenyl-N-[[5-(2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-2-propynamide IUPAC Name: 3-phenyl-N-[(5-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]prop-2-ynamide Traditional Name: 3-phenyl-N-[(5-pyrazin-2-ylcoumaran-2-yl)methyl]propiolamide Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C=C2)C3=NC=CN=C3)CNC(=O)C#CC4=CC=CC=C4

Isomeric SMILES

C1C(OC2=C1C=C(C=C2)C3=NC=CN=C3)CNC(=O)C#CC4=CC=CC=C4

InChI

InChI=1S/C22H17N3O2/c26-22(9-6-16-4-2-1-3-5-16)25-14-19-13-18-12-17(7-8-21(18)27-19)20-15-23-10-11-24-20/h1-5,7-8,10-12,15,19H,13-14H2,(H,25,26)