methyl 6-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]-3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: methyl 6-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]-3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: methyl 6-[[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]methylsulfanyl]chromane-3-carboxylate CAS Name: 6-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methylthio]-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]-3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: 6-[[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]methylthio]chroman-3-carboxylic acid methyl ester Formula: C23H20F3NO3S2 MolecularWeight: 479.53501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)CSC3=CC4=C(C=C3)OCC(C4)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)CSC3=CC4=C(C=C3)OCC(C4)C(=O)OC

InChI

InChI=1S/C23H20F3NO3S2/c1-13-20(32-21(27-13)14-3-5-17(6-4-14)23(24,25)26)12-31-18-7-8-19-15(10-18)9-16(11-30-19)22(28)29-2/h3-8,10,16H,9,11-12H2,1-2H3