6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione

Systemtic Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione Openeye Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-(4-pyridylmethyl)pyrimidine-2,4-dione CAS Name: 6-[(3,5-dimethylphenyl)thio]-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione IUPAC Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-(pyridin-4-ylmethyl)pyrimidine-2,4-dione Traditional Name: 6-[(3,5-dimethylphenyl)thio]-5-ethyl-1-(4-pyridylmethyl)pyrimidine-2,4-quinone Formula: C20H21N3O2S MolecularWeight: 367.46464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=O)NC1=O)CC2=CC=NC=C2)SC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCC1=C(N(C(=O)NC1=O)CC2=CC=NC=C2)SC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C20H21N3O2S/c1-4-17-18(24)22-20(25)23(12-15-5-7-21-8-6-15)19(17)26-16-10-13(2)9-14(3)11-16/h5-11H,4,12H2,1-3H3,(H,22,24,25)