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

Systemtic Name: 3-[[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propylamino]methyl]-N,N-dimethyl-aniline Openeye Name: 3-[[3-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)propylamino]methyl]-N,N-dimethyl-aniline CAS Name: 3-[[3-(1,2-dimethyl-5-oxo-10-phenothiazinyl)propylamino]methyl]-N,N-dimethylaniline IUPAC Name: 3-[[3-(1,2-dimethyl-5-oxophenothiazin-10-yl)propylamino]methyl]-N,N-dimethylaniline Traditional Name: [3-[[3-(5-keto-1,2-dimethyl-phenothiazin-10-yl)propylamino]methyl]phenyl]-dimethyl-amine Formula: C26H31N3OS MolecularWeight: 433.60884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N3OS/c1-19-13-14-25-26(20(19)2)29(23-11-5-6-12-24(23)31(25)30)16-8-15-27-18-21-9-7-10-22(17-21)28(3)4/h5-7,9-14,17,27H,8,15-16,18H2,1-4H3