N-Carbamothioylimino-1-(3-Chlorophenyl)-4-Methoxy-5-(2-Phenylhydrazinyl)Pyrazole-3-Carboxamide
[CAS# 172701-56-3]

Identification

• Name: N-Carbamothioylimino-1-(3-Chlorophenyl)-4-Methoxy-5-(2-Phenylhydrazinyl)Pyrazole-3-Carboxamide
• Synonyms: N-Carbamothioylimino-1-(3-Chlorophenyl)-4-Methoxy-5-(N'-Phenylhydrazino)Pyrazole-3-Carboxamide; N-Carbamothioylimino-1-(3-Chlorophenyl)-4-Methoxy-5-(N'-Phenylhydrazino)-3-Pyrazolecarboxamide; 1-(3-Chlorophenyl)-4-Methoxy-5-(N'-Phenylhydrazino)-N-Thiocarbamoylimino-Pyrazole-3-Carboxamide
• Molecular Formula: C₁₈H₁₆ClN₇O₂S
• Molecular Weight: 429.88
• CAS Registry Number: 172701-56-3
• SMILES: C3=C([N]1N=C(C(=C1NNC2=CC=CC=C2)OC)C(=O)N=NC(=S)N)C=CC=C3Cl
• InChI: 1S/C18H16ClN7O2S/c1-28-15-14(17(27)23-24-18(20)29)25-26(13-9-5-6-11(19)10-13)16(15)22-21-12-7-3-2-4-8-12/h2-10,21-22H,1H3,(H2,20,29)
• InChIKey: ROPCBXSUXDHBGJ-UHFFFAOYSA-N

Properties

• Density: 1.489g/cm³ (Cal.)
• Boiling point: 577.317°C at 760 mmHg (Cal.)
• Flash point: 302.95°C (Cal.)