methyl 3-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanylpropanoate

Systemtic Name: methyl 3-(2-oxidanylidene-2-phenothiazin-10-yl-ethyl)sulfanylpropanoate Openeye Name: methyl 3-(2-oxo-2-phenothiazin-10-yl-ethyl)sulfanylpropanoate CAS Name: 3-[[2-oxo-2-(10-phenothiazinyl)ethyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-(2-oxo-2-phenothiazin-10-ylethyl)sulfanylpropanoate Traditional Name: 3-[(2-keto-2-phenothiazin-10-yl-ethyl)thio]propionic acid methyl ester Formula: C18H17NO3S2 MolecularWeight: 359.46248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31

Isomeric SMILES

COC(=O)CCSCC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31

InChI

InChI=1S/C18H17NO3S2/c1-22-18(21)10-11-23-12-17(20)19-13-6-2-4-8-15(13)24-16-9-5-3-7-14(16)19/h2-9H,10-12H2,1H3