N-(1,3-benzothiazol-2-yl)-2-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]butanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]butanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]butanamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]butanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]butanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[(6-tert-butyl-3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)thio]butyramide Formula: C25H28N4OS2 MolecularWeight: 464.64602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=CC=CC=C2S1)SC3=NC4=C(CC(CC4)C(C)(C)C)C=C3C#N

Isomeric SMILES

CCC(C(=O)NC1=NC2=CC=CC=C2S1)SC3=NC4=C(CC(CC4)C(C)(C)C)C=C3C#N

InChI

InChI=1S/C25H28N4OS2/c1-5-20(22(30)29-24-28-19-8-6-7-9-21(19)32-24)31-23-16(14-26)12-15-13-17(25(2,3)4)10-11-18(15)27-23/h6-9,12,17,20H,5,10-11,13H2,1-4H3,(H,28,29,30)