N-[3-cyano-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1,4-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-cyano-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1,4-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-1,4-dimethyl-pyrazole-3-carboxamide CAS Name: N-[3-cyano-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1,4-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-1,4-dimethylpyrazole-3-carboxamide Traditional Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)-1,4-dimethyl-pyrazole-3-carboxamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1C(=O)NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C#N)C

Isomeric SMILES

CC1=CN(N=C1C(=O)NC2=C(C3=C(S2)CN(CC3)CC4=CC=CC=C4)C#N)C

InChI

InChI=1S/C21H21N5OS/c1-14-11-25(2)24-19(14)20(27)23-21-17(10-22)16-8-9-26(13-18(16)28-21)12-15-6-4-3-5-7-15/h3-7,11H,8-9,12-13H2,1-2H3,(H,23,27)