4-[3-[4-(2-dimethylaminoethyloxy)phenyl]-5,7-bis(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[3-[4-(2-dimethylaminoethyloxy)phenyl]-5,7-bis(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[3-[4-(2-dimethylaminoethyloxy)phenyl]-5,7-bis(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[3-[4-(2-dimethylaminoethyloxy)phenyl]-5,7-bis(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[3-[4-(2-dimethylaminoethyloxy)phenyl]-5,7-bis(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-[4-(2-dimethylaminoethyloxy)phenyl]-5,7-bis(trifluoromethyl)-1H-pyrazolo[1,5-a]pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C24H20F6N4O2 MolecularWeight: 510.431619

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC=C(C=C1)C2=C3N=C(C=C(N3NC2=C4C=CC(=O)C=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CN(C)CCOC1=CC=C(C=C1)C2=C3N=C(C=C(N3NC2=C4C=CC(=O)C=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C24H20F6N4O2/c1-33(2)11-12-36-17-9-5-14(6-10-17)20-21(15-3-7-16(35)8-4-15)32-34-19(24(28,29)30)13-18(23(25,26)27)31-22(20)34/h3-10,13,32H,11-12H2,1-2H3