1-[5,5-bis(oxidanylidene)-2-(trifluoromethyl)phenothiazin-10-yl]-3-imidazol-1-yl-propan-1-one

Systemtic Name: 1-[5,5-bis(oxidanylidene)-2-(trifluoromethyl)phenothiazin-10-yl]-3-imidazol-1-yl-propan-1-one Openeye Name: 1-[5,5-dioxo-2-(trifluoromethyl)phenothiazin-10-yl]-3-imidazol-1-yl-propan-1-one CAS Name: 1-[5,5-dioxo-2-(trifluoromethyl)-10-phenothiazinyl]-3-(1-imidazolyl)-1-propanone IUPAC Name: 1-[5,5-dioxo-2-(trifluoromethyl)phenothiazin-10-yl]-3-imidazol-1-ylpropan-1-one Traditional Name: 1-[5,5-diketo-2-(trifluoromethyl)phenothiazin-10-yl]-3-imidazol-1-yl-propan-1-one Formula: C19H14F3N3O3S MolecularWeight: 421.39297

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=C(S2(=O)=O)C=CC(=C3)C(F)(F)F)C(=O)CCN4C=CN=C4

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=C(S2(=O)=O)C=CC(=C3)C(F)(F)F)C(=O)CCN4C=CN=C4

InChI

InChI=1S/C19H14F3N3O3S/c20-19(21,22)13-5-6-17-15(11-13)25(18(26)7-9-24-10-8-23-12-24)14-3-1-2-4-16(14)29(17,27)28/h1-6,8,10-12H,7,9H2