5-[(2,5-dimethylphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde Openeye Name: 5-[(2,5-dimethylphenyl)methyl]-4-oxo-2-thioxo-1H-pyrimidine-6-carbaldehyde CAS Name: 5-[(2,5-dimethylphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-6-carboxaldehyde IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde Traditional Name: 5-(2,5-dimethylbenzyl)-4-keto-2-thioxo-1H-pyrimidine-6-carbaldehyde Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2=C(NC(=S)NC2=O)C=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2=C(NC(=S)NC2=O)C=O

InChI

InChI=1S/C14H14N2O2S/c1-8-3-4-9(2)10(5-8)6-11-12(7-17)15-14(19)16-13(11)18/h3-5,7H,6H2,1-2H3,(H2,15,16,18,19)