ethyl 4-[2-[butyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-[butyl(methyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-[butyl(methyl)amino]-2-oxo-ethyl]sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[[2-[butyl(methyl)amino]-2-oxoethyl]thio]-6-methyl-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[butyl(methyl)amino]-2-oxoethyl]sulfanyl-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[[2-[butyl(methyl)amino]-2-keto-ethyl]thio]-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CSC1=NC(=NC(=C1C(=O)OCC)C)C2=CC=CC=C2

Isomeric SMILES

CCCCN(C)C(=O)CSC1=NC(=NC(=C1C(=O)OCC)C)C2=CC=CC=C2

InChI

InChI=1S/C21H27N3O3S/c1-5-7-13-24(4)17(25)14-28-20-18(21(26)27-6-2)15(3)22-19(23-20)16-11-9-8-10-12-16/h8-12H,5-7,13-14H2,1-4H3