N-[(4-methoxy-2-methyl-5-propan-2-yl-phenyl)methyl]-2-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-[(4-methoxy-2-methyl-5-propan-2-yl-phenyl)methyl]-2-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-[(5-isopropyl-4-methoxy-2-methyl-phenyl)methyl]-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methyl]-2-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-[(4-methoxy-2-methyl-5-propan-2-ylphenyl)methyl]-2-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-(5-isopropyl-4-methoxy-2-methyl-benzyl)-2-(methylthio)pyrimidine-5-carboxamide Formula: C18H23N3O2S MolecularWeight: 345.45912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CNC(=O)C2=CN=C(N=C2)SC)C(C)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CNC(=O)C2=CN=C(N=C2)SC)C(C)C)OC

InChI

InChI=1S/C18H23N3O2S/c1-11(2)15-7-13(12(3)6-16(15)23-4)8-19-17(22)14-9-20-18(24-5)21-10-14/h6-7,9-11H,8H2,1-5H3,(H,19,22)