3-[1,2-dimethyl-5,5-bis(oxidanylidene)phenothiazin-10-yl]propan-1-amine

Systemtic Name: 3-[1,2-dimethyl-5,5-bis(oxidanylidene)phenothiazin-10-yl]propan-1-amine Openeye Name: 3-(1,2-dimethyl-5,5-dioxo-phenothiazin-10-yl)propan-1-amine CAS Name: 3-(1,2-dimethyl-5,5-dioxo-10-phenothiazinyl)-1-propanamine IUPAC Name: 3-(1,2-dimethyl-5,5-dioxophenothiazin-10-yl)propan-1-amine Traditional Name: 3-(5,5-diketo-1,2-dimethyl-phenothiazin-10-yl)propylamine Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O2S/c1-12-8-9-16-17(13(12)2)19(11-5-10-18)14-6-3-4-7-15(14)22(16,20)21/h3-4,6-9H,5,10-11,18H2,1-2H3