4-methyl-N-[4-(1-oxidanylidene-1-phenothiazin-10-yl-propan-2-yl)sulfanylphenyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[4-(1-oxidanylidene-1-phenothiazin-10-yl-propan-2-yl)sulfanylphenyl]benzenesulfonamide Openeye Name: 4-methyl-N-[4-(1-methyl-2-oxo-2-phenothiazin-10-yl-ethyl)sulfanylphenyl]benzenesulfonamide CAS Name: 4-methyl-N-[4-[[1-oxo-1-(10-phenothiazinyl)propan-2-yl]thio]phenyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[4-(1-oxo-1-phenothiazin-10-ylpropan-2-yl)sulfanylphenyl]benzenesulfonamide Traditional Name: N-[4-[(2-keto-1-methyl-2-phenothiazin-10-yl-ethyl)thio]phenyl]-4-methyl-benzenesulfonamide Formula: C28H24N2O3S3 MolecularWeight: 532.69676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SC(C)C(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)SC(C)C(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C28H24N2O3S3/c1-19-11-17-23(18-12-19)36(32,33)29-21-13-15-22(16-14-21)34-20(2)28(31)30-24-7-3-5-9-26(24)35-27-10-6-4-8-25(27)30/h3-18,20,29H,1-2H3