5-chloranyl-N-[2-(2,6-dimethylphenoxy)ethyl]-2-methylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(2,6-dimethylphenoxy)ethyl]-2-methylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[2-(2,6-dimethylphenoxy)ethyl]-2-methylsulfanyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[2-(2,6-dimethylphenoxy)ethyl]-2-(methylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[2-(2,6-dimethylphenoxy)ethyl]-2-methylsulfanylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[2-(2,6-dimethylphenoxy)ethyl]-2-(methylthio)pyrimidine-4-carboxamide Formula: C16H18ClN3O2S MolecularWeight: 351.85102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCNC(=O)C2=NC(=NC=C2Cl)SC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCNC(=O)C2=NC(=NC=C2Cl)SC

InChI

InChI=1S/C16H18ClN3O2S/c1-10-5-4-6-11(2)14(10)22-8-7-18-15(21)13-12(17)9-19-16(20-13)23-3/h4-6,9H,7-8H2,1-3H3,(H,18,21)