N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-cyano-6-propyl-pyridin-2-yl)sulfanyl-propanamide Openeye Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[(3-cyano-6-propyl-2-pyridyl)sulfanyl]propanamide CAS Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(3-cyano-6-propyl-2-pyridinyl)thio]propanamide IUPAC Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(3-cyano-6-propylpyridin-2-yl)sulfanylpropanamide Traditional Name: N-(6-tert-butyl-3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[(3-cyano-6-propyl-2-pyridyl)thio]propionamide Formula: C25H30N4OS2 MolecularWeight: 466.6619

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SCCC(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N

InChI

InChI=1S/C25H30N4OS2/c1-5-6-18-9-7-16(14-26)23(28-18)31-12-11-22(30)29-24-20(15-27)19-10-8-17(25(2,3)4)13-21(19)32-24/h7,9,17H,5-6,8,10-13H2,1-4H3,(H,29,30)