methyl 2-[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: methyl 2-[2-(2-chlorophenothiazin-10-yl)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(2-chloro-10-phenothiazinyl)-2-oxoethyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-chlorophenothiazin-10-yl)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(2-chlorophenothiazin-10-yl)-2-keto-ethyl]thio]acetic acid methyl ester Formula: C17H14ClNO3S2 MolecularWeight: 379.88096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl

Isomeric SMILES

COC(=O)CSCC(=O)N1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl

InChI

InChI=1S/C17H14ClNO3S2/c1-22-17(21)10-23-9-16(20)19-12-4-2-3-5-14(12)24-15-7-6-11(18)8-13(15)19/h2-8H,9-10H2,1H3