3-(8-chloranyl-1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)-N-(phenylmethyl)propan-1-amine

Systemtic Name: 3-(8-chloranyl-1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)-N-(phenylmethyl)propan-1-amine Openeye Name: N-benzyl-3-(8-chloro-1,2-dimethyl-5-oxo-phenothiazin-10-yl)propan-1-amine CAS Name: 3-(8-chloro-1,2-dimethyl-5-oxo-10-phenothiazinyl)-N-(phenylmethyl)-1-propanamine IUPAC Name: N-benzyl-3-(8-chloro-1,2-dimethyl-5-oxophenothiazin-10-yl)propan-1-amine Traditional Name: benzyl-[3-(8-chloro-5-keto-1,2-dimethyl-phenothiazin-10-yl)propyl]amine Formula: C24H25ClN2OS MolecularWeight: 424.9861

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=C(N2CCCNCC4=CC=CC=C4)C=C(C=C3)Cl)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=C(N2CCCNCC4=CC=CC=C4)C=C(C=C3)Cl)C

InChI

InChI=1S/C24H25ClN2OS/c1-17-9-11-23-24(18(17)2)27(21-15-20(25)10-12-22(21)29(23)28)14-6-13-26-16-19-7-4-3-5-8-19/h3-5,7-12,15,26H,6,13-14,16H2,1-2H3