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

Systemtic Name: N-(4-tert-butyl-2-thianthren-5-ium-5-yl-phenyl)ethanamide perchlorate Openeye Name: N-(4-tert-butyl-2-thianthren-5-ium-5-yl-phenyl)acetamide perchlorate CAS Name: N-[4-tert-butyl-2-(5-thianthren-5-iumyl)phenyl]acetamide perchlorate IUPAC Name: N-(4-tert-butyl-2-thianthren-5-ium-5-ylphenyl)acetamide perchlorate Traditional Name: N-(4-tert-butyl-2-thianthren-5-ium-5-yl-phenyl)acetamide perchlorate Formula: C24H24ClNO5S2 MolecularWeight: 506.03406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)C(C)(C)C)[S+]2C3=CC=CC=C3SC4=CC=CC=C42.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)C(C)(C)C)[S+]2C3=CC=CC=C3SC4=CC=CC=C42.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C24H23NOS2.ClHO4/c1-16(26)25-18-14-13-17(24(2,3)4)15-23(18)28-21-11-7-5-9-19(21)27-20-10-6-8-12-22(20)28;2-1(3,4)5/h5-15H,1-4H3;(H,2,3,4,5)