4-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)-N-(phenylmethyl)butan-1-amine

Systemtic Name: 4-(1,2-dimethyl-5-oxidanylidene-phenothiazin-10-yl)-N-(phenylmethyl)butan-1-amine Openeye Name: N-benzyl-4-(1,2-dimethyl-5-oxo-phenothiazin-10-yl)butan-1-amine CAS Name: 4-(1,2-dimethyl-5-oxo-10-phenothiazinyl)-N-(phenylmethyl)-1-butanamine IUPAC Name: N-benzyl-4-(1,2-dimethyl-5-oxophenothiazin-10-yl)butan-1-amine Traditional Name: benzyl-[4-(5-keto-1,2-dimethyl-phenothiazin-10-yl)butyl]amine Formula: C25H28N2OS MolecularWeight: 404.56762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCCNCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCCNCC4=CC=CC=C4)C

InChI

InChI=1S/C25H28N2OS/c1-19-14-15-24-25(20(19)2)27(22-12-6-7-13-23(22)29(24)28)17-9-8-16-26-18-21-10-4-3-5-11-21/h3-7,10-15,26H,8-9,16-18H2,1-2H3