2-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide

Systemtic Name: 2-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide Openeye Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide CAS Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 2-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(6-methoxy-1,3-benzothiazol-2-yl)butanamide Traditional Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(6-methoxy-1,3-benzothiazol-2-yl)butyramide Formula: C32H28N4O4S2 MolecularWeight: 596.71912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=C(C(=CC=C5)OC)OC)C#N

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)OC)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=C(C(=CC=C5)OC)OC)C#N

InChI

InChI=1S/C32H28N4O4S2/c1-5-27(30(37)36-32-35-24-15-14-20(38-2)16-28(24)42-32)41-31-23(18-33)22(17-25(34-31)19-10-7-6-8-11-19)21-12-9-13-26(39-3)29(21)40-4/h6-17,27H,5H2,1-4H3,(H,35,36,37)