(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 3-(2-methylindolin-1-yl)sulfonylbenzoate CAS Name: 3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 3-[(2-methyl-2,3-dihydroindol-1-yl)sulfonyl]benzoate Traditional Name: 3-(2-methylindolin-1-yl)sulfonylbenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C30H24N2O5S2 MolecularWeight: 556.65196

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

Isomeric SMILES

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)OCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64

InChI

InChI=1S/C30H24N2O5S2/c1-20-17-21-9-2-3-12-24(21)32(20)39(35,36)23-11-8-10-22(18-23)30(34)37-19-29(33)31-25-13-4-6-15-27(25)38-28-16-7-5-14-26(28)31/h2-16,18,20H,17,19H2,1H3