[2-(3,5-ditert-butylphenyl)-5,6,7,8-tetrahydro-1,3-benzothiazin-4-ylidene]-methyl-sulfanium

Systemtic Name: [2-(3,5-ditert-butylphenyl)-5,6,7,8-tetrahydro-1,3-benzothiazin-4-ylidene]-methyl-sulfanium Openeye Name: [2-(3,5-ditert-butylphenyl)-5,6,7,8-tetrahydro-1,3-benzothiazin-4-ylidene]-methyl-sulfonium CAS Name: [2-(3,5-ditert-butylphenyl)-5,6,7,8-tetrahydro-1,3-benzothiazin-4-ylidene]-methylsulfonium IUPAC Name: [2-(3,5-ditert-butylphenyl)-5,6,7,8-tetrahydro-1,3-benzothiazin-4-ylidene]-methylsulfanium Traditional Name: [2-(3,5-ditert-butylphenyl)-5,6,7,8-tetrahydro-1,3-benzothiazin-4-ylidene]-methyl-sulfonium Formula: C23H32NS2+ MolecularWeight: 386.63688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=NC(=[S+]C)C3=C(S2)CCCC3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=NC(=[S+]C)C3=C(S2)CCCC3)C(C)(C)C

InChI

InChI=1S/C23H32NS2/c1-22(2,3)16-12-15(13-17(14-16)23(4,5)6)20-24-21(25-7)18-10-8-9-11-19(18)26-20/h12-14H,8-11H2,1-7H3/q+1