6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-[(E)-3-(furan-2-yl)prop-2-enyl]pyrimidine-2,4-dione

Systemtic Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-[(E)-3-(furan-2-yl)prop-2-enyl]pyrimidine-2,4-dione Openeye Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-[(E)-3-(2-furyl)allyl]pyrimidine-2,4-dione CAS Name: 6-[(3,5-dimethylphenyl)thio]-5-ethyl-1-[(E)-3-(2-furanyl)prop-2-enyl]pyrimidine-2,4-dione IUPAC Name: 6-(3,5-dimethylphenyl)sulfanyl-5-ethyl-1-[(E)-3-(furan-2-yl)prop-2-enyl]pyrimidine-2,4-dione Traditional Name: 6-[(3,5-dimethylphenyl)thio]-5-ethyl-1-[(E)-3-(2-furyl)allyl]pyrimidine-2,4-quinone Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=O)NC1=O)CC=CC2=CC=CO2)SC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCC1=C(N(C(=O)NC1=O)C/C=C/C2=CC=CO2)SC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C21H22N2O3S/c1-4-18-19(24)22-21(25)23(9-5-7-16-8-6-10-26-16)20(18)27-17-12-14(2)11-15(3)13-17/h5-8,10-13H,4,9H2,1-3H3,(H,22,24,25)/b7-5+