4-[4-(3-methoxyphenyl)piperazin-1-yl]-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidine

Systemtic Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidine Openeye Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidine CAS Name: 4-[4-(3-methoxyphenyl)-1-piperazinyl]-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidine IUPAC Name: 4-[4-(3-methoxyphenyl)piperazin-1-yl]-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidine Traditional Name: 4-[4-(3-methoxyphenyl)piperazino]-5-phenyl-7-[3-(trifluoromethyl)phenyl]pyrrolo[2,3-d]pyrimidine Formula: C30H26F3N5O MolecularWeight: 529.55555

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC=NC4=C3C(=CN4C5=CC=CC(=C5)C(F)(F)F)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C3=NC=NC4=C3C(=CN4C5=CC=CC(=C5)C(F)(F)F)C6=CC=CC=C6

InChI

InChI=1S/C30H26F3N5O/c1-39-25-12-6-10-23(18-25)36-13-15-37(16-14-36)28-27-26(21-7-3-2-4-8-21)19-38(29(27)35-20-34-28)24-11-5-9-22(17-24)30(31,32)33/h2-12,17-20H,13-16H2,1H3