4-(2,4-dimethylphenyl)-6-methyl-2-methylsulfanyl-N-[(E)-3-phenylprop-2-enyl]pyrimidine-5-carboxamide

Systemtic Name: 4-(2,4-dimethylphenyl)-6-methyl-2-methylsulfanyl-N-[(E)-3-phenylprop-2-enyl]pyrimidine-5-carboxamide Openeye Name: N-[(E)-cinnamyl]-4-(2,4-dimethylphenyl)-6-methyl-2-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: 4-(2,4-dimethylphenyl)-6-methyl-2-(methylthio)-N-[(E)-3-phenylprop-2-enyl]-5-pyrimidinecarboxamide IUPAC Name: 4-(2,4-dimethylphenyl)-6-methyl-2-methylsulfanyl-N-[(E)-3-phenylprop-2-enyl]pyrimidine-5-carboxamide Traditional Name: N-[(E)-cinnamyl]-4-(2,4-dimethylphenyl)-6-methyl-2-(methylthio)pyrimidine-5-carboxamide Formula: C24H25N3OS MolecularWeight: 403.5398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(C(=NC(=N2)SC)C)C(=O)NCC=CC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(C(=NC(=N2)SC)C)C(=O)NC/C=C/C3=CC=CC=C3)C

InChI

InChI=1S/C24H25N3OS/c1-16-12-13-20(17(2)15-16)22-21(18(3)26-24(27-22)29-4)23(28)25-14-8-11-19-9-6-5-7-10-19/h5-13,15H,14H2,1-4H3,(H,25,28)/b11-8+