10-[[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]methyl]-2-(trifluoromethyl)phenothiazine

Systemtic Name: 10-[[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]methyl]-2-(trifluoromethyl)phenothiazine Openeye Name: 10-[[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]methyl]-2-(trifluoromethyl)phenothiazine CAS Name: 10-[[4-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]methyl]-2-(trifluoromethyl)phenothiazine IUPAC Name: 10-[[4-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]methyl]-2-(trifluoromethyl)phenothiazine Traditional Name: 10-[4-[[4-(2-pyrimidyl)piperazino]methyl]benzyl]-2-(trifluoromethyl)phenothiazine Formula: C29H26F3N5S MolecularWeight: 533.61045

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)CN3C4=CC=CC=C4SC5=C3C=C(C=C5)C(F)(F)F)C6=NC=CC=N6

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)CN3C4=CC=CC=C4SC5=C3C=C(C=C5)C(F)(F)F)C6=NC=CC=N6

InChI

InChI=1S/C29H26F3N5S/c30-29(31,32)23-10-11-27-25(18-23)37(24-4-1-2-5-26(24)38-27)20-22-8-6-21(7-9-22)19-35-14-16-36(17-15-35)28-33-12-3-13-34-28/h1-13,18H,14-17,19-20H2