2-[5-(4-nitrophenyl)-1,2,3,4-tetrazol-2-yl]-1-phenothiazin-10-yl-ethanone

Systemtic Name: 2-[5-(4-nitrophenyl)-1,2,3,4-tetrazol-2-yl]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[5-(4-nitrophenyl)tetrazol-2-yl]-1-phenothiazin-10-yl-ethanone CAS Name: 2-[5-(4-nitrophenyl)-2-tetrazolyl]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[5-(4-nitrophenyl)tetrazol-2-yl]-1-phenothiazin-10-ylethanone Traditional Name: 2-[5-(4-nitrophenyl)tetrazol-2-yl]-1-phenothiazin-10-yl-ethanone Formula: C21H14N6O3S MolecularWeight: 430.43926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)CN4N=C(N=N4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)CN4N=C(N=N4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H14N6O3S/c28-20(13-25-23-21(22-24-25)14-9-11-15(12-10-14)27(29)30)26-16-5-1-3-7-18(16)31-19-8-4-2-6-17(19)26/h1-12H,13H2