5-Methoxy-3-(1-methylethoxy)-N-1H-tetrazol-5-yl-Benzo(b)thiophene-2-carboxamide monosodium salt
[CAS# 104795-68-8]

Identification

• Name: 5-Methoxy-3-(1-methylethoxy)-N-1H-tetrazol-5-yl-Benzo(b)thiophene-2-carboxamide monosodium salt
• Synonyms: Sodium 3-Isopropoxy-5-Methoxy-N-(2,3,4-Triaza-1-Azanidacyclopenta-2,4-Dien-5-Yl)Benzothiophene-2-Carboxamide; Sodium 3-Isopropoxy-5-Methoxy-N-(2,3,4-Triaza-1-Azanidacyclopenta-2,4-Dien-5-Yl)-2-Benzothiophenecarboxamide; Ci-959
• Molecular Formula: C₁₄H₁₄N₅NaO₃S
• Molecular Weight: 355.35
• CAS Registry Number: 104795-68-8
• SMILES: [N-]3N=C(NC(=O)C1=C(OC(C)C)C2=C(S1)C=CC(=C2)OC)N=N3.[Na+]
• InChI: 1S/C14H15N5O3S.Na/c1-7(2)22-11-9-6-8(21-3)4-5-10(9)23-12(11)13(20)15-14-16-18-19-17-14;/h4-7H,1-3H3,(H2,15,16,17,18,19,20);/q;+1/p-1
• InChIKey: UCLODRCAPZIYOW-UHFFFAOYSA-M

Properties

• Boiling point: 598.6°C at 760 mmHg (Cal.)
• Flash point: 315.8°C (Cal.)