4-nitro-N-[4-(1-oxidanylidene-1-phenothiazin-10-yl-propan-2-yl)sulfanylphenyl]benzamide

Systemtic Name: 4-nitro-N-[4-(1-oxidanylidene-1-phenothiazin-10-yl-propan-2-yl)sulfanylphenyl]benzamide Openeye Name: N-[4-(1-methyl-2-oxo-2-phenothiazin-10-yl-ethyl)sulfanylphenyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[4-[[1-oxo-1-(10-phenothiazinyl)propan-2-yl]thio]phenyl]benzamide IUPAC Name: 4-nitro-N-[4-(1-oxo-1-phenothiazin-10-ylpropan-2-yl)sulfanylphenyl]benzamide Traditional Name: N-[4-[(2-keto-1-methyl-2-phenothiazin-10-yl-ethyl)thio]phenyl]-4-nitro-benzamide Formula: C28H21N3O4S2 MolecularWeight: 527.61404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)N1C2=CC=CC=C2SC3=CC=CC=C31)SC4=CC=C(C=C4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H21N3O4S2/c1-18(28(33)30-23-6-2-4-8-25(23)37-26-9-5-3-7-24(26)30)36-22-16-12-20(13-17-22)29-27(32)19-10-14-21(15-11-19)31(34)35/h2-18H,1H3,(H,29,32)