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

Systemtic Name: (4-nitrophenyl)-[5-(2-phenothiazin-10-ylethyl)-1,2,3,4-tetrazol-1-yl]methanone Openeye Name: (4-nitrophenyl)-[5-(2-phenothiazin-10-ylethyl)tetrazol-1-yl]methanone CAS Name: (4-nitrophenyl)-[5-[2-(10-phenothiazinyl)ethyl]-1-tetrazolyl]methanone IUPAC Name: (4-nitrophenyl)-[5-(2-phenothiazin-10-ylethyl)tetrazol-1-yl]methanone Traditional Name: (4-nitrophenyl)-[5-(2-phenothiazin-10-ylethyl)tetrazol-1-yl]methanone Formula: C22H16N6O3S MolecularWeight: 444.46584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC4=NN=NN4C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC4=NN=NN4C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H16N6O3S/c29-22(15-9-11-16(12-10-15)28(30)31)27-21(23-24-25-27)13-14-26-17-5-1-3-7-19(17)32-20-8-4-2-6-18(20)26/h1-12H,13-14H2