10-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,2-dimethyl-phenothiazine 5-oxide

Systemtic Name: 10-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,2-dimethyl-phenothiazine 5-oxide Openeye Name: 10-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,2-dimethyl-phenothiazine 5-oxide CAS Name: 10-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,2-dimethylphenothiazine 5-oxide IUPAC Name: 10-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,2-dimethylphenothiazine 5-oxide Traditional Name: 10-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,2-dimethyl-phenothiazine 5-oxide Formula: C26H28N2OS MolecularWeight: 416.57832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CC1=C(C2=C(C=C1)S(=O)C3=CC=CC=C3N2CCCN4CCC5=CC=CC=C5C4)C

InChI

InChI=1S/C26H28N2OS/c1-19-12-13-25-26(20(19)2)28(23-10-5-6-11-24(23)30(25)29)16-7-15-27-17-14-21-8-3-4-9-22(21)18-27/h3-6,8-13H,7,14-18H2,1-2H3