5-[(4-bromophenyl)methyl]-2-ethylsulfanyl-4-oxidanylidene-1H-pyrimidine-6-carbaldehyde

Systemtic Name: 5-[(4-bromophenyl)methyl]-2-ethylsulfanyl-4-oxidanylidene-1H-pyrimidine-6-carbaldehyde Openeye Name: 5-[(4-bromophenyl)methyl]-2-ethylsulfanyl-4-oxo-1H-pyrimidine-6-carbaldehyde CAS Name: 5-[(4-bromophenyl)methyl]-2-(ethylthio)-4-oxo-1H-pyrimidine-6-carboxaldehyde IUPAC Name: 5-[(4-bromophenyl)methyl]-2-ethylsulfanyl-4-oxo-1H-pyrimidine-6-carbaldehyde Traditional Name: 5-(4-bromobenzyl)-2-(ethylthio)-4-keto-1H-pyrimidine-6-carbaldehyde Formula: C14H13BrN2O2S MolecularWeight: 353.23422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=O)C(=C(N1)C=O)CC2=CC=C(C=C2)Br

Isomeric SMILES

CCSC1=NC(=O)C(=C(N1)C=O)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H13BrN2O2S/c1-2-20-14-16-12(8-18)11(13(19)17-14)7-9-3-5-10(15)6-4-9/h3-6,8H,2,7H2,1H3,(H,16,17,19)