Vitas-M small molecule compound
2-(4-acetylphenyl)-3-amino-1-thioxo-1,2,5,6,7,8-hexahydroisoquinoline-4-carbonitrile
Catalog ID
STK615750
SMILES N#Cc1c(N)n(c2ccc(cc2)C(=O)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 C18H17N3OS MW 323.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3OS/c1-11(22)12-6-8-13(9-7-12)21-17(20)16(10-19)14-4-2-3-5-15(14)18(21)23/h6-9H,2-5,20H2,1H3InChIKey
VMMPTFKGAMEXMA-UHFFFAOYSA-NSynonyms
903584-43-02(4acetylphenyl)3amino1sulfanylidene5678tetrahydroisoquinoline4carbonitrile
2(4acetylphenyl)3amino1thioxo125678hexahydroisoquinoline4carbonitrile
903584430
CC(=O)C1=CC=C(C=C1)N2C(=C(C3=C(C2=S)CCCC3)C#N)N
InChI=1SC18H17N3OSc111(22)126813(9712)2117(20)16(1019)14423515(14)18(21)23h69H2520H21H3
MFCD08292660
ZINC000006719347
ZINC06719347
ZINC6719347
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