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N-(2,2-Dimethoxyethyl)-6-[5-(phenylsulfanyl)-2-thienyl]nicotinamide
[CAS# 864685-28-9]

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CAS#: 864685-28-9
Product: N-(2,2-Dimethoxyethyl)-6-[5-(phenylsulfanyl)-2-thienyl]nicotinamide
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Identification
Name N-(2,2-Dimethoxyethyl)-6-[5-(phenylsulfanyl)-2-thienyl]nicotinamide
Synonyms 3-PYRIDINECARBOXAMIDE,N-(2,2-DIMETHOXYETHYL)-6-[5-(PHENYLTHIO)-2-THIENYL]-
Molecular Structure CAS#: 864685-28-9, N-(2,2-Dimethoxyethyl)-6-[5-(phenylsulfanyl)-2-thienyl]nicotinamide
Molecular Formula C20H20N2O3S2
Molecular Weight 400.51
CAS Registry Number 864685-28-9
SMILES COC(OC)CNC(=O)c1ccc(nc1)c3ccc(Sc2ccccc2)s3
InChI 1S/C20H20N2O3S2/c1-24-18(25-2)13-22-20(23)14-8-9-16(21-12-14)17-10-11-19(27-17)26-15-6-4-3-5-7-15/h3-12,18H,13H2,1-2H3,(H,22,23)
InChIKey NVCMXIXPZUZJMN-UHFFFAOYSA-N
Properties
Density 1.313g/cm3 (Cal.)
Boiling point 604.565°C at 760 mmHg (Cal.)
Flash point 319.43°C (Cal.)
Refractive index 1.644 (Cal.)
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