Vitas-M small molecule compound
3-amino-2-(2-hydroxyethyl)-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Catalog ID
STL240220
SMILES OCCn1c(N)c(C#N)c2c(c1=S)CCCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H15N3OS MW 249.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3OS/c13-7-10-8-3-1-2-4-9(8)12(17)15(5-6-16)11(10)14/h16H,1-6,14H2InChIKey
NZYXDXXDXINECK-UHFFFAOYSA-NSynonyms
919723-70-93amino2(2hydroxyethyl)1sulfanylidene5678tetrahydroisoquinoline4carbonitrile
3amino2(2hydroxyethyl)1thioxo125678hexahydroisoquinoline4carbonitrile
919723709
C1CCC2=C(C1)C(=C(N(C2=S)CCO)N)C#N
InChI=1SC12H15N3OSc13710831249(8)12(17)15(5616)11(10)14h16H1614H2
MFCD08744782
ZINC000013625031
ZINC13625031
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