N-(4-tert-butylphenyl)-2-(7-oxidanylidenebenzo[a]phenalen-3-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-(7-oxidanylidenebenzo[a]phenalen-3-yl)sulfanyl-ethanamide Openeye Name: N-(4-tert-butylphenyl)-2-(7-oxobenzo[a]phenalen-3-yl)sulfanyl-acetamide CAS Name: N-(4-tert-butylphenyl)-2-[(7-oxo-3-benzo[a]phenalenyl)thio]acetamide IUPAC Name: N-(4-tert-butylphenyl)-2-(7-oxobenzo[a]phenalen-3-yl)sulfanylacetamide Traditional Name: N-(4-tert-butylphenyl)-2-[(7-ketobenzo[a]phenalen-3-yl)thio]acetamide Formula: C29H25NO2S MolecularWeight: 451.5793

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)CSC2=C3C=CC=C4C3=C(C=C2)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)CSC2=C3C=CC=C4C3=C(C=C2)C5=CC=CC=C5C4=O

InChI

InChI=1S/C29H25NO2S/c1-29(2,3)18-11-13-19(14-12-18)30-26(31)17-33-25-16-15-21-20-7-4-5-8-22(20)28(32)24-10-6-9-23(25)27(21)24/h4-16H,17H2,1-3H3,(H,30,31)