N-(4-tert-butyl-2-thianthren-5-ium-5-yl-phenyl)-N-methyl-ethanamide

Systemtic Name: N-(4-tert-butyl-2-thianthren-5-ium-5-yl-phenyl)-N-methyl-ethanamide Openeye Name: N-(4-tert-butyl-2-thianthren-5-ium-5-yl-phenyl)-N-methyl-acetamide CAS Name: N-[4-tert-butyl-2-(5-thianthren-5-iumyl)phenyl]-N-methylacetamide IUPAC Name: N-(4-tert-butyl-2-thianthren-5-ium-5-ylphenyl)-N-methylacetamide Traditional Name: N-(4-tert-butyl-2-thianthren-5-ium-5-yl-phenyl)-N-methyl-acetamide Formula: C25H26NOS2+ MolecularWeight: 420.61004

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=C(C=C(C=C1)C(C)(C)C)[S+]2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CC(=O)N(C)C1=C(C=C(C=C1)C(C)(C)C)[S+]2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C25H26NOS2/c1-17(27)26(5)19-15-14-18(25(2,3)4)16-24(19)29-22-12-8-6-10-20(22)28-21-11-7-9-13-23(21)29/h6-16H,1-5H3/q+1