2-[[methyl-[3-(1,2,8-trimethyl-5-oxidanylidene-phenothiazin-10-yl)propyl]amino]methyl]phenol

Systemtic Name: 2-[[methyl-[3-(1,2,8-trimethyl-5-oxidanylidene-phenothiazin-10-yl)propyl]amino]methyl]phenol Openeye Name: 2-[[methyl-[3-(1,2,8-trimethyl-5-oxo-phenothiazin-10-yl)propyl]amino]methyl]phenol CAS Name: 2-[[methyl-[3-(1,2,8-trimethyl-5-oxo-10-phenothiazinyl)propyl]amino]methyl]phenol IUPAC Name: 2-[[methyl-[3-(1,2,8-trimethyl-5-oxophenothiazin-10-yl)propyl]amino]methyl]phenol Traditional Name: 2-[[3-(5-keto-1,2,8-trimethyl-phenothiazin-10-yl)propyl-methyl-amino]methyl]phenol Formula: C26H30N2O2S MolecularWeight: 434.5936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)S(=O)C3=C(N2CCCN(C)CC4=CC=CC=C4O)C(=C(C=C3)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)S(=O)C3=C(N2CCCN(C)CC4=CC=CC=C4O)C(=C(C=C3)C)C

InChI

InChI=1S/C26H30N2O2S/c1-18-10-12-24-22(16-18)28(26-20(3)19(2)11-13-25(26)31(24)30)15-7-14-27(4)17-21-8-5-6-9-23(21)29/h5-6,8-13,16,29H,7,14-15,17H2,1-4H3