3-methoxy-6-[5-(2-methyl-1,3-thiazol-4-yl)-2-sulfanylidene-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 3-methoxy-6-[5-(2-methyl-1,3-thiazol-4-yl)-2-sulfanylidene-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 3-methoxy-6-[5-(2-methylthiazol-4-yl)-2-thioxo-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 3-methoxy-6-[5-(2-methyl-4-thiazolyl)-2-sulfanylidene-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 3-methoxy-6-[5-(2-methyl-1,3-thiazol-4-yl)-2-sulfanylidene-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 3-methoxy-6-[5-(2-methylthiazol-4-yl)-2-thioxo-6-(trifluoromethyl)-1H-pyrimidin-4-ylidene]cyclohexa-2,4-dien-1-one Formula: C16H12F3N3O2S2 MolecularWeight: 399.41059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=C(NC(=S)NC2=C3C=CC(=CC3=O)OC)C(F)(F)F

Isomeric SMILES

CC1=NC(=CS1)C2=C(NC(=S)NC2=C3C=CC(=CC3=O)OC)C(F)(F)F

InChI

InChI=1S/C16H12F3N3O2S2/c1-7-20-10(6-26-7)12-13(9-4-3-8(24-2)5-11(9)23)21-15(25)22-14(12)16(17,18)19/h3-6H,1-2H3,(H2,21,22,25)