1-[5,5-bis(oxidanylidene)phenothiazin-10-yl]-2-pyrazol-1-yl-ethanone

Systemtic Name: 1-[5,5-bis(oxidanylidene)phenothiazin-10-yl]-2-pyrazol-1-yl-ethanone Openeye Name: 1-(5,5-dioxophenothiazin-10-yl)-2-pyrazol-1-yl-ethanone CAS Name: 1-(5,5-dioxo-10-phenothiazinyl)-2-(1-pyrazolyl)ethanone IUPAC Name: 1-(5,5-dioxophenothiazin-10-yl)-2-pyrazol-1-ylethanone Traditional Name: 1-(5,5-diketophenothiazin-10-yl)-2-pyrazol-1-yl-ethanone Formula: C17H13N3O3S MolecularWeight: 339.36842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2(=O)=O)C(=O)CN4C=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2(=O)=O)C(=O)CN4C=CC=N4

InChI

InChI=1S/C17H13N3O3S/c21-17(12-19-11-5-10-18-19)20-13-6-1-3-8-15(13)24(22,23)16-9-4-2-7-14(16)20/h1-11H,12H2