1-({5-[(1H-Indol-3-ylmethyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-3-(1,3-thiazol-2-ylamino)-2-propanol
[CAS# 86717-13-7]

Identification

• Name: 1-({5-[(1H-Indol-3-ylmethyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)-3-(1,3-thiazol-2-ylamino)-2-propanol
• Synonyms: BRN 6012918
• Molecular Formula: C₁₇H₁₈N₆OS₃
• Molecular Weight: 418.56
• CAS Registry Number: 86717-13-7
• SMILES: OC(CSc1nnc(s1)NCc3c2ccccc2nc3)CNc4nccs4
• InChI: 1S/C17H18N6OS3/c24-12(9-21-15-18-5-6-25-15)10-26-17-23-22-16(27-17)20-8-11-7-19-14-4-2-1-3-13(11)14/h1-7,12,19,24H,8-10H2,(H,18,21)(H,20,22)
• InChIKey: ONAXWVKKXWMBAU-UHFFFAOYSA-N

Properties

• Density: 1.528g/cm³ (Cal.)
• Boiling point: 713.766°C at 760 mmHg (Cal.)
• Flash point: 385.472°C (Cal.)