4-(4-Chlorobenzyl)-3-Thiosemicarbazide
[CAS# 6610-36-2]

Identification

• Name: 4-(4-Chlorobenzyl)-3-Thiosemicarbazide
• Synonyms: 3-Methoxy-N-[(2-Methyl-3-Oxazolo[4,5-B]Pyridin-2-Yl-Phenyl)Carbamothioyl]Naphthalene-2-Carboxamide; 3-Methoxy-N-[[[2-Methyl-3-(2-Oxazolo[4,5-B]Pyridinyl)Phenyl]Amino]-Thioxomethyl]-2-Naphthalenecarboxamide; 3-Methoxy-N-[(2-Methyl-3-Oxazolo[4,5-B]Pyridin-2-Yl-Phenyl)Thiocarbamoyl]-2-Naphthamide
• Molecular Formula: C₂₆H₂₀N₄O₃S
• Molecular Weight: 468.53
• CAS Registry Number: 6610-36-2
• SMILES: C1=C5C(=CC(=C1C(=O)NC(=S)NC2=C(C(=CC=C2)C4=NC3=NC=CC=C3O4)C)OC)C=CC=C5
• InChI: 1S/C26H20N4O3S/c1-15-18(25-29-23-21(33-25)11-6-12-27-23)9-5-10-20(15)28-26(34)30-24(31)19-13-16-7-3-4-8-17(16)14-22(19)32-2/h3-14H,1-2H3,(H2,28,30,31,34)
• InChIKey: YNPOHTTXJHWXLA-UHFFFAOYSA-N

Properties

• Density: 1.371g/cm³ (Cal.)