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

Systemtic Name: 5-ethyl-6-methyl-2-[2-oxidanylidene-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 5-ethyl-6-methyl-2-[2-oxo-2-[(4-phenylthiazol-2-yl)amino]ethyl]sulfanyl-pyrimidin-4-olate CAS Name: 5-ethyl-6-methyl-2-[[2-oxo-2-[(4-phenyl-2-thiazolyl)amino]ethyl]thio]-4-pyrimidinolate IUPAC Name: 5-ethyl-6-methyl-2-[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]sulfanylpyrimidin-4-olate Traditional Name: 5-ethyl-2-[[2-keto-2-[(4-phenylthiazol-2-yl)amino]ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C18H17N4O2S2- MolecularWeight: 385.48318

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1[O-])SCC(=O)NC2=NC(=CS2)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(N=C(N=C1[O-])SCC(=O)NC2=NC(=CS2)C3=CC=CC=C3)C

InChI

InChI=1S/C18H18N4O2S2/c1-3-13-11(2)19-17(22-16(13)24)26-10-15(23)21-18-20-14(9-25-18)12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3,(H,19,22,24)(H,20,21,23)/p-1