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

Systemtic Name: N-[3-cyano-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]dodecanamide Openeye Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)dodecanamide CAS Name: N-[3-cyano-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]dodecanamide IUPAC Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)dodecanamide Traditional Name: N-(6-benzyl-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)lauramide Formula: C27H37N3OS MolecularWeight: 451.66718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NC1=C(C2=C(S1)CN(CC2)CC3=CC=CC=C3)C#N

Isomeric SMILES

CCCCCCCCCCCC(=O)NC1=C(C2=C(S1)CN(CC2)CC3=CC=CC=C3)C#N

InChI

InChI=1S/C27H37N3OS/c1-2-3-4-5-6-7-8-9-13-16-26(31)29-27-24(19-28)23-17-18-30(21-25(23)32-27)20-22-14-11-10-12-15-22/h10-12,14-15H,2-9,13,16-18,20-21H2,1H3,(H,29,31)