5-(3,4-Dimethoxyphenyl)-2H-Tetrazole-2-Acetic Acid 2-(((4-Chlorophe Nyl)Amino)Thioxomethyl)Hydrazide
[CAS# 94771-99-0]

Identification

• Name: 5-(3,4-Dimethoxyphenyl)-2H-Tetrazole-2-Acetic Acid 2-(((4-Chlorophe Nyl)Amino)Thioxomethyl)Hydrazide
• Synonyms: 1-(4-Chlorophenyl)-3-[[2-[5-(3,4-Dimethoxyphenyl)-2-Tetrazolyl]-1-Oxoethyl]Amino]Thiourea; 1-(4-Chlorophenyl)-3-[2-[5-(3,4-Dimethoxyphenyl)-1,2,3,4-Tetrazol-2-Yl]Ethanoylamino]Thiourea; 4-(4-Chlorophenyl)-1-(5-(3,4-Dimethoxyphenyl)Tetrazol-2-Yl-Acetyl)Thios
• Molecular Formula: C₁₈H₁₈ClN₇O₃S
• Molecular Weight: 447.90
• CAS Registry Number: 94771-99-0
• SMILES: C3=C(C1=N[N](N=N1)CC(=O)NNC(=S)NC2=CC=C(Cl)C=C2)C=CC(=C3OC)OC
• InChI: 1S/C18H18ClN7O3S/c1-28-14-8-3-11(9-15(14)29-2)17-22-25-26(24-17)10-16(27)21-23-18(30)20-13-6-4-12(19)5-7-13/h3-9H,10H2,1-2H3,(H,21,27)(H2,20,23,30)
• InChIKey: MCLRSKQPGOQPMO-UHFFFAOYSA-N

Properties

• Density: 1.482g/cm³ (Cal.)