4-[3-[7-(oxan-2-yloxy)-2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[3-[7-(oxan-2-yloxy)-2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazine-1-carbaldehyde Openeye Name: 4-[3-[7-tetrahydropyran-2-yloxy-2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazine-1-carbaldehyde CAS Name: 4-[3-[7-(2-oxanyloxy)-2-(trifluoromethyl)-10-phenothiazinyl]propyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[3-[7-(oxan-2-yloxy)-2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazine-1-carbaldehyde Traditional Name: 4-[3-[7-tetrahydropyran-2-yloxy-2-(trifluoromethyl)phenothiazin-10-yl]propyl]piperazine-1-carbaldehyde Formula: C26H30F3N3O3S MolecularWeight: 521.59491

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OC2=CC3=C(C=C2)N(C4=C(S3)C=CC(=C4)C(F)(F)F)CCCN5CCN(CC5)C=O

Isomeric SMILES

C1CCOC(C1)OC2=CC3=C(C=C2)N(C4=C(S3)C=CC(=C4)C(F)(F)F)CCCN5CCN(CC5)C=O

InChI

InChI=1S/C26H30F3N3O3S/c27-26(28,29)19-5-8-23-22(16-19)32(10-3-9-30-11-13-31(18-33)14-12-30)21-7-6-20(17-24(21)36-23)35-25-4-1-2-15-34-25/h5-8,16-18,25H,1-4,9-15H2