Vitas-M small molecule compound
2-amino-4-{3-[(2-chlorophenoxy)methyl]-4-methoxyphenyl}-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Catalog ID
STK961064
SMILES N#CC1=C(N)C(C(C2C1=CCCC2)c1ccc(c(c1)COc1ccccc1Cl)OC)(C#N)C#N
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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 C27H23ClN4O2 MW 470.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClN4O2/c1-33-23-11-10-17(12-18(23)14-34-24-9-5-4-8-22(24)28)25-20-7-3-2-6-19(20)21(13-29)26(32)27(25,15-30)16-31/h4-6,8-12,20,25H,2-3,7,14,32H2,1H3InChIKey
KEQMUOXTPUGDRA-UHFFFAOYSA-NSynonyms
445033-14-72AMINO4(3((2CHLOROPHENOXY)METHYL)4METHOXYPHENYL)4A567TETRAHYDRO4HNAPHTHALENE133TRICARBONITRILE
2amino4(3((2chlorophenoxy)methyl)4methoxyphenyl)4a567tetrahydronaphthalene133(4H)tricarbonitrile
445033147
COC1=C(C=C(C=C1)C2C3CCCC=C3C(=C(C2(C#N)C#N)N)C#N)COC4=CC=CC=C4Cl
InChI=1SC27H23ClN4O2c13323111017(1218(23)143424954822(24)28)2520732619(20)21(1329)26(32)27(251530)1631h468122025H2371432H21H3
MFCD02243823
ZINC000002769725
ZINC000002769728
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