Compound C14H17ClN2S

5-methylsulfanyl-3-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)-1H-indole chloride

CAS: 77248-66-9

Molecular Formula	`C14H17ClN2S`
Molecular Weight	280.8 g/mol
Topological Polar Surface Area	57.7 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	2
Rotatable Bonds	2
Exact Mass	280.0801
Heavy Atoms	18
Complexity	303.0

Chemical Identifiers

CAS Number	77248-66-9
SMILES	`CSC1=CC2=C(C=C1)NC=C2C3=CC[NH2+]CC3.[Cl-]`
InChIKey	`LWUTUIGRZHGJDW-UHFFFAOYSA-N`

📖 Product Overview

Compound C14H17ClN2S (CAS: 77248-66-9) is a chemical compound with molecular formula C14H17ClN2S and molecular weight 280.8 g/mol. Its IUPAC systematic name is 5-methylsulfanyl-3-(1,2,3,6-tetrahydropyridin-1-ium-4-yl)-1H-indole chloride. Topological Polar Surface Area 57.7 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 2 Rotatable Bonds 2 Exact Mass 280.0801 Heavy Atoms 18 Complexity 303.0 InChI Key: LWUTUIGRZHGJDW-UHFFFAOYSA-N. SMILES: CSC1=CC2=C(C=C1)NC=C2C3=CC[NH2+]CC3.[Cl-].

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