2-(2,6-dimethylphenyl)-5-methyl-7-phenylsulfanyl-3H-1$l^{4},4,2-benzodithiazine 1-oxide

Systemtic Name: 2-(2,6-dimethylphenyl)-5-methyl-7-phenylsulfanyl-3H-1$l^{4},4,2-benzodithiazine 1-oxide Openeye Name: 2-(2,6-dimethylphenyl)-5-methyl-7-phenylsulfanyl-3H-1$l^{4},4,2-benzodithiazine 1-oxide CAS Name: 2-(2,6-dimethylphenyl)-5-methyl-7-(phenylthio)-3H-1$l^{4},4,2-benzodithiazine 1-oxide IUPAC Name: 2-(2,6-dimethylphenyl)-5-methyl-7-phenylsulfanyl-3H-1$l^{4},4,2-benzodithiazine 1-oxide Traditional Name: 2-(2,6-dimethylphenyl)-5-methyl-7-(phenylthio)-3H-1$l^{4},4,2-benzodithiazine 1-oxide Formula: C22H21NOS3 MolecularWeight: 411.60324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CSC3=C(S2=O)C=C(C=C3C)SC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CSC3=C(S2=O)C=C(C=C3C)SC4=CC=CC=C4

InChI

InChI=1S/C22H21NOS3/c1-15-8-7-9-16(2)21(15)23-14-25-22-17(3)12-19(13-20(22)27(23)24)26-18-10-5-4-6-11-18/h4-13H,14H2,1-3H3