[6-(3-methoxy-4-phenylmethoxy-phenyl)-4-oxidanyl-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinan-5-yl]-thiophen-2-yl-methanone

Systemtic Name: [6-(3-methoxy-4-phenylmethoxy-phenyl)-4-oxidanyl-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinan-5-yl]-thiophen-2-yl-methanone Openeye Name: [6-(4-benzyloxy-3-methoxy-phenyl)-4-hydroxy-2-thioxo-4-(trifluoromethyl)hexahydropyrimidin-5-yl]-(2-thienyl)methanone CAS Name: [4-hydroxy-6-(3-methoxy-4-phenylmethoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinan-5-yl]-thiophen-2-ylmethanone IUPAC Name: [4-hydroxy-6-(3-methoxy-4-phenylmethoxyphenyl)-2-sulfanylidene-4-(trifluoromethyl)-1,3-diazinan-5-yl]-thiophen-2-ylmethanone Traditional Name: [6-(4-benzoxy-3-methoxy-phenyl)-4-hydroxy-2-thioxo-4-(trifluoromethyl)hexahydropyrimidin-5-yl]-(2-thienyl)methanone Formula: C24H21F3N2O4S2 MolecularWeight: 522.55975

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2C(C(NC(=S)N2)(C(F)(F)F)O)C(=O)C3=CC=CS3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)C2C(C(NC(=S)N2)(C(F)(F)F)O)C(=O)C3=CC=CS3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H21F3N2O4S2/c1-32-17-12-15(9-10-16(17)33-13-14-6-3-2-4-7-14)20-19(21(30)18-8-5-11-35-18)23(31,24(25,26)27)29-22(34)28-20/h2-12,19-20,31H,13H2,1H3,(H2,28,29,34)