2-[2-[(4,5-diphenyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[(4,5-diphenyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate Openeye Name: 2-[2-[(4,5-diphenylthiazol-2-yl)amino]-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[2-[(4,5-diphenyl-2-thiazolyl)amino]-2-oxoethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-[(4,5-diphenyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[2-[(4,5-diphenylthiazol-2-yl)amino]-2-keto-ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C22H17N4O2S2- MolecularWeight: 433.52598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=NC(=C(S2)C3=CC=CC=C3)C4=CC=CC=C4)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=NC(=C(S2)C3=CC=CC=C3)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C22H18N4O2S2/c1-14-12-17(27)24-21(23-14)29-13-18(28)25-22-26-19(15-8-4-2-5-9-15)20(30-22)16-10-6-3-7-11-16/h2-12H,13H2,1H3,(H,23,24,27)(H,25,26,28)/p-1