S-[4-(2-Methyl-2-propanyl)benzyl] (2-cyclopentyl-3-pyridinyl)carbamothioate
[CAS# 42754-15-4]

Identification

• Name: S-[4-(2-Methyl-2-propanyl)benzyl] (2-cyclopentyl-3-pyridinyl)carbamothioate
• Synonyms: S-[(4-Tert-Butylphenyl)Methyl] [(2-Cyclopentyl-3-Pyridyl)Amino]Methanethioate; [(2-Cyclopentyl-3-Pyridyl)Amino]Methanethioic Acid S-[(4-Tert-Butylphenyl)Methyl] Ester; [(2-Cyclopentyl-3-Pyridyl)Amino]Methanethioic Acid S-(4-Tert-Butylbenzyl) Ester
• Molecular Formula: C₂₂H₂₈N₂OS
• Molecular Weight: 368.54
• CAS Registry Number: 42754-15-4
• SMILES: C2=C(NC(=O)SCC1=CC=C(C=C1)C(C)(C)C)C(=NC=C2)C3CCCC3
• InChI: 1S/C22H28N2OS/c1-22(2,3)18-12-10-16(11-13-18)15-26-21(25)24-19-9-6-14-23-20(19)17-7-4-5-8-17/h6,9-14,17H,4-5,7-8,15H2,1-3H3,(H,24,25)
• InChIKey: ADHQJMYIPLKKBP-UHFFFAOYSA-N

Properties

• Density: 1.15g/cm³ (Cal.)