3a-methyl-2-[4-(trifluoromethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazol-3-one

Systemtic Name: 3a-methyl-2-[4-(trifluoromethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazol-3-one Openeye Name: 3a-methyl-2-[4-(trifluoromethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazol-3-one CAS Name: 3a-methyl-2-[4-(trifluoromethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazol-3-one IUPAC Name: 3a-methyl-2-[4-(trifluoromethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazol-3-one Traditional Name: 3a-methyl-2-[4-(trifluoromethyl)phenyl]-4H-thiochromeno[4,3-c]pyrazol-3-one Formula: C18H13F3N2OS MolecularWeight: 362.36883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CSC3=CC=CC=C3C1=NN(C2=O)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC12CSC3=CC=CC=C3C1=NN(C2=O)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C18H13F3N2OS/c1-17-10-25-14-5-3-2-4-13(14)15(17)22-23(16(17)24)12-8-6-11(7-9-12)18(19,20)21/h2-9H,10H2,1H3