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

Systemtic Name: 2-[5-(4-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-1-phenothiazin-10-yl-ethanone Openeye Name: 2-[5-(4-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-1-phenothiazin-10-yl-ethanone CAS Name: 2-[5-(4-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-1-(10-phenothiazinyl)ethanone IUPAC Name: 2-[5-(4-nitrophenyl)-3-phenyl-3,4-dihydropyrazol-2-yl]-1-phenothiazin-10-ylethanone Traditional Name: 2-[3-(4-nitrophenyl)-5-phenyl-2-pyrazolin-1-yl]-1-phenothiazin-10-yl-ethanone Formula: C29H22N4O3S MolecularWeight: 506.57498

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)[N+](=O)[O-])CC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

Isomeric SMILES

C1C(N(N=C1C2=CC=C(C=C2)[N+](=O)[O-])CC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53)C6=CC=CC=C6

InChI

InChI=1S/C29H22N4O3S/c34-29(32-24-10-4-6-12-27(24)37-28-13-7-5-11-25(28)32)19-31-26(21-8-2-1-3-9-21)18-23(30-31)20-14-16-22(17-15-20)33(35)36/h1-17,26H,18-19H2