2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxidanylidene-1H-pyrimidin-2-yl]sulfanyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidin-2-yl]thio]-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-oxo-1H-pyrimidin-2-yl]sulfanyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: 2-[[5-cyano-6-(4-dimethylaminophenyl)-4-keto-1H-pyrimidin-2-yl]thio]-N-(5-propyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C20H21N7O2S2 MolecularWeight: 455.55644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)CSC2=NC(=O)C(=C(N2)C3=CC=C(C=C3)N(C)C)C#N

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)CSC2=NC(=O)C(=C(N2)C3=CC=C(C=C3)N(C)C)C#N

InChI

InChI=1S/C20H21N7O2S2/c1-4-5-16-25-26-20(31-16)22-15(28)11-30-19-23-17(14(10-21)18(29)24-19)12-6-8-13(9-7-12)27(2)3/h6-9H,4-5,11H2,1-3H3,(H,22,26,28)(H,23,24,29)