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

Systemtic Name: 4-[[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propyl-methyl-amino]methyl]phenol Openeye Name: 4-[[3-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)propyl-methyl-amino]methyl]phenol CAS Name: 4-[[3-(1,2-dimethyl-5-oxo-10-phenothiazinyl)propyl-methylamino]methyl]phenol IUPAC Name: 4-[[3-(1,2-dimethyl-5-oxophenothiazin-10-yl)propyl-methylamino]methyl]phenol Traditional Name: 4-[[3-(5-keto-1,2-dimethyl-phenothiazin-10-yl)propyl-methyl-amino]methyl]phenol Formula: C25H28N2O2S MolecularWeight: 420.56702

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN(C)CC4=CC=C(C=C4)O)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN(C)CC4=CC=C(C=C4)O)C

InChI

InChI=1S/C25H28N2O2S/c1-18-9-14-24-25(19(18)2)27(22-7-4-5-8-23(22)30(24)29)16-6-15-26(3)17-20-10-12-21(28)13-11-20/h4-5,7-14,28H,6,15-17H2,1-3H3