Amocarzine
[CAS# 99402-78-5]

Identification

• Name: Amocarzine
• Synonyms: 4-Methyl-N-[4-[(4-Nitrophenyl)Amino]Phenyl]-1-Piperazinecarbothioamide; Amocarzinum [Inn-Latin]; Cgp 6140
• Molecular Formula: C₁₈H₂₁N₅O₂S
• Molecular Weight: 371.46
• CAS Registry Number: 99402-78-5
• SMILES: C2=C(NC(N1CCN(C)CC1)=S)C=CC(=C2)NC3=CC=C([N+](=O)[O-])C=C3
• InChI: 1S/C18H21N5O2S/c1-21-10-12-22(13-11-21)18(26)20-16-4-2-14(3-5-16)19-15-6-8-17(9-7-15)23(24)25/h2-9,19H,10-13H2,1H3,(H,20,26)
• InChIKey: UFLRJROFPAGRPN-UHFFFAOYSA-N

Properties

• Density: 1.361g/cm³ (Cal.)
• Boiling point: 533.562°C at 760 mmHg (Cal.)
• Flash point: 276.489°C (Cal.)