N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-2-(2-pyrimidylthio)acetamide Formula: C17H16N4O3S2 MolecularWeight: 388.46394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=NC=CC=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=O)CSC3=NC=CC=N3)OC

InChI

InChI=1S/C17H16N4O3S2/c1-23-13-5-4-11(8-14(13)24-2)12-9-25-17(20-12)21-15(22)10-26-16-18-6-3-7-19-16/h3-9H,10H2,1-2H3,(H,20,21,22)