Vitas-M small molecule compound
3-amino-2-[4-(propan-2-yloxy)benzyl]-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Catalog ID
STL232892
SMILES N#Cc1c(N)n(Cc2ccc(cc2)OC(C)C)c(=S)c2c1CCCC2
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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 C20H23N3OS MW 353.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3OS/c1-13(2)24-15-9-7-14(8-10-15)12-23-19(22)18(11-21)16-5-3-4-6-17(16)20(23)25/h7-10,13H,3-6,12,22H2,1-2H3InChIKey
PNQBXUFBIBNXDT-UHFFFAOYSA-NSynonyms
919745-61-23amino2((4propan2yloxyphenyl)methyl)1sulfanylidene5678tetrahydroisoquinoline4carbonitrile
3amino2(4(propan2yloxy)benzyl)1thioxo125678hexahydroisoquinoline4carbonitrile
3amino2(4isopropoxybenzyl)1thioxo125678hexahydroisoquinoline4carbonitrile
919745612
CC(C)OC1=CC=C(C=C1)CN2C(=C(C3=C(C2=S)CCCC3)C#N)N
InChI=1SC20H23N3OSc113(2)24159714(81015)122319(22)18(1121)16534617(16)20(23)25h71013H361222H212H3
MFCD08747102
ZINC000009305365
ZINC09305365
ZINC9305365
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