(E)-2-cyano-N-(3-imidazol-1-ylpropyl)-3-(8-methoxy-2-methyl-2H-chromen-3-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-imidazol-1-ylpropyl)-3-(8-methoxy-2-methyl-2H-chromen-3-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-imidazol-1-ylpropyl)-3-(8-methoxy-2-methyl-2H-chromen-3-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-[3-(1-imidazolyl)propyl]-3-(8-methoxy-2-methyl-2H-1-benzopyran-3-yl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-imidazol-1-ylpropyl)-3-(8-methoxy-2-methyl-2H-chromen-3-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-imidazol-1-ylpropyl)-3-(8-methoxy-2-methyl-2H-chromen-3-yl)acrylamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CC2=C(O1)C(=CC=C2)OC)C=C(C#N)C(=O)NCCCN3C=CN=C3

Isomeric SMILES

CC1C(=CC2=C(O1)C(=CC=C2)OC)/C=C(\C#N)/C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C21H22N4O3/c1-15-17(11-16-5-3-6-19(27-2)20(16)28-15)12-18(13-22)21(26)24-7-4-9-25-10-8-23-14-25/h3,5-6,8,10-12,14-15H,4,7,9H2,1-2H3,(H,24,26)/b18-12+