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

Systemtic Name: 2-[[2-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)ethylamino]methyl]-6-(methoxymethyl)phenol Openeye Name: 2-[[2-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)ethylamino]methyl]-6-(methoxymethyl)phenol CAS Name: 2-[[2-(1,2-dimethyl-5-oxo-10-phenothiazinyl)ethylamino]methyl]-6-(methoxymethyl)phenol IUPAC Name: 2-[[2-(1,2-dimethyl-5-oxophenothiazin-10-yl)ethylamino]methyl]-6-(methoxymethyl)phenol Traditional Name: 2-[[2-(5-keto-1,2-dimethyl-phenothiazin-10-yl)ethylamino]methyl]-6-(methoxymethyl)phenol Formula: C25H28N2O3S MolecularWeight: 436.56642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N2O3S/c1-17-11-12-23-24(18(17)2)27(21-9-4-5-10-22(21)31(23)29)14-13-26-15-19-7-6-8-20(16-30-3)25(19)28/h4-12,26,28H,13-16H2,1-3H3