N-[2-(4-methoxyphenyl)ethyl]-4-methyl-6-methylsulfanyl-2-thiophen-2-yl-pyrimidine-5-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-6-methylsulfanyl-2-thiophen-2-yl-pyrimidine-5-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-6-methylsulfanyl-2-(2-thienyl)pyrimidine-5-carboxamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-6-(methylthio)-2-thiophen-2-yl-5-pyrimidinecarboxamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-6-methylsulfanyl-2-thiophen-2-ylpyrimidine-5-carboxamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-4-methyl-6-(methylthio)-2-(2-thienyl)pyrimidine-5-carboxamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CS2)SC)C(=O)NCCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CS2)SC)C(=O)NCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N3O2S2/c1-13-17(20(26-3)23-18(22-13)16-5-4-12-27-16)19(24)21-11-10-14-6-8-15(25-2)9-7-14/h4-9,12H,10-11H2,1-3H3,(H,21,24)