N-[3-cyano-6-(2-imidazol-1-ylethanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-3-phenyl-propanamide

Systemtic Name: N-[3-cyano-6-(2-imidazol-1-ylethanoyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-3-phenyl-propanamide Openeye Name: N-[3-cyano-6-(2-imidazol-1-ylacetyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-3-phenyl-propanamide CAS Name: N-[3-cyano-6-[2-(1-imidazolyl)-1-oxoethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-3-phenylpropanamide IUPAC Name: N-[3-cyano-6-(2-imidazol-1-ylacetyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-3-phenylpropanamide Traditional Name: N-[3-cyano-6-(2-imidazol-1-ylacetyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-3-phenyl-propionamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=C(S2)NC(=O)CCC3=CC=CC=C3)C#N)C(=O)CN4C=CN=C4

Isomeric SMILES

C1CN(CC2=C1C(=C(S2)NC(=O)CCC3=CC=CC=C3)C#N)C(=O)CN4C=CN=C4

InChI

InChI=1S/C22H21N5O2S/c23-12-18-17-8-10-27(21(29)14-26-11-9-24-15-26)13-19(17)30-22(18)25-20(28)7-6-16-4-2-1-3-5-16/h1-5,9,11,15H,6-8,10,13-14H2,(H,25,28)