4-[[2-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)ethylamino]methyl]-2,6-dimethoxy-phenol

Systemtic Name: 4-[[2-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)ethylamino]methyl]-2,6-dimethoxy-phenol Openeye Name: 4-[[2-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)ethylamino]methyl]-2,6-dimethoxy-phenol CAS Name: 4-[[2-(1,2-dimethyl-5-oxo-10-phenothiazinyl)ethylamino]methyl]-2,6-dimethoxyphenol IUPAC Name: 4-[[2-(1,2-dimethyl-5-oxophenothiazin-10-yl)ethylamino]methyl]-2,6-dimethoxyphenol Traditional Name: 4-[[2-(5-keto-1,2-dimethyl-phenothiazin-10-yl)ethylamino]methyl]-2,6-dimethoxy-phenol Formula: C25H28N2O4S MolecularWeight: 452.56582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCNCC4=CC(=C(C(=C4)OC)O)OC)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCNCC4=CC(=C(C(=C4)OC)O)OC)C

InChI

InChI=1S/C25H28N2O4S/c1-16-9-10-23-24(17(16)2)27(19-7-5-6-8-22(19)32(23)29)12-11-26-15-18-13-20(30-3)25(28)21(14-18)31-4/h5-10,13-14,26,28H,11-12,15H2,1-4H3