methoxy-(4-methyl-2-phenethyl-6-sulfanylidene-pyrimidin-5-ylidene)methanolate

Systemtic Name: methoxy-(4-methyl-2-phenethyl-6-sulfanylidene-pyrimidin-5-ylidene)methanolate Openeye Name: methoxy-(4-methyl-2-phenethyl-6-thioxo-pyrimidin-5-ylidene)methanolate CAS Name: methoxy-(4-methyl-2-phenethyl-6-sulfanylidene-5-pyrimidinylidene)methanolate IUPAC Name: methoxy-(4-methyl-2-phenethyl-6-sulfanylidenepyrimidin-5-ylidene)methanolate Traditional Name: methoxy-(4-methyl-2-phenethyl-6-thioxo-pyrimidin-5-ylidene)methanolate Formula: C15H15N2O2S- MolecularWeight: 287.3568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=S)C1=C([O-])OC)CCC2=CC=CC=C2

Isomeric SMILES

CC1=NC(=NC(=S)C1=C([O-])OC)CCC2=CC=CC=C2

InChI

InChI=1S/C15H16N2O2S/c1-10-13(15(18)19-2)14(20)17-12(16-10)9-8-11-6-4-3-5-7-11/h3-7,18H,8-9H2,1-2H3/p-1