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

Systemtic Name: 2-[[3-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)propylamino]methyl]aniline Openeye Name: 2-[[3-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)propylamino]methyl]aniline CAS Name: 2-[[3-(1,2-dimethyl-5-oxo-10-phenothiazinyl)propylamino]methyl]aniline IUPAC Name: 2-[[3-(1,2-dimethyl-5-oxophenothiazin-10-yl)propylamino]methyl]aniline Traditional Name: (2-aminobenzyl)-[3-(5-keto-1,2-dimethyl-phenothiazin-10-yl)propyl]amine Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCNCC4=CC=CC=C4N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCNCC4=CC=CC=C4N)C

InChI

InChI=1S/C24H27N3OS/c1-17-12-13-23-24(18(17)2)27(21-10-5-6-11-22(21)29(23)28)15-7-14-26-16-19-8-3-4-9-20(19)25/h3-6,8-13,26H,7,14-16,25H2,1-2H3