4-[[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propylamino]methyl]phenol

Systemtic Name: 4-[[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propylamino]methyl]phenol Openeye Name: 4-[[3-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)propylamino]methyl]phenol CAS Name: 4-[[3-(1,2-dimethyl-5-oxo-10-phenothiazinyl)propylamino]methyl]phenol IUPAC Name: 4-[[3-(1,2-dimethyl-5-oxophenothiazin-10-yl)propylamino]methyl]phenol Traditional Name: 4-[[3-(5-keto-1,2-dimethyl-phenothiazin-10-yl)propylamino]methyl]phenol Formula: C24H26N2O2S MolecularWeight: 406.54044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCNCC4=CC=C(C=C4)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCNCC4=CC=C(C=C4)O)C

InChI

InChI=1S/C24H26N2O2S/c1-17-8-13-23-24(18(17)2)26(21-6-3-4-7-22(21)29(23)28)15-5-14-25-16-19-9-11-20(27)12-10-19/h3-4,6-13,25,27H,5,14-16H2,1-2H3