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SCFBio, IIT Delhi Hauz Khas, New Delhi
Structure
Compound BIMP021461

Allithiamine

Formula: C15H22N4O2S2  |  Mol. Weight: 354.50 g/mol

IUPAC: N-[(4-amino-2-methylpyrimidin-5-yl)methyl]-N-[(E)-5-hydroxy-3-(prop-2-enyldisulfanyl)pent-2-en-2-yl]formamide

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Overview

Molecular Formula C15H22N4O2S2
Molecular Weight 354.50 g/mol
Canonical SMILES CC1=NC=C(C(=N1)N)CN(C=O)C(=C(CCO)SSCC=C)C

Structure (2D/3D)

Chemical Identifiers

Chemical Properties

Compound Classification

Pharmacokinetics (GIA/BBB)

Druglikeness Rules

Taxonomy