Vitas-M small molecule compound
2-amino-4-{3-[(4-chlorophenoxy)methyl]-4-methoxyphenyl}-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Catalog ID
STK960673
SMILES N#CC1=C(N)C(C(C2C1=CCCC2)c1ccc(c(c1)COc1ccc(cc1)Cl)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/c1-33-24-11-6-17(12-18(24)14-34-20-9-7-19(28)8-10-20)25-22-5-3-2-4-21(22)23(13-29)26(32)27(25,15-30)16-31/h4,6-12,22,25H,2-3,5,14,32H2,1H3InChIKey
RUSDJUYRFKGANO-UHFFFAOYSA-NSynonyms
445031-56-12AMINO4(3((4CHLOROPHENOXY)METHYL)4METHOXYPHENYL)4A567TETRAHYDRO4HNAPHTHALENE133TRICARBONITRILE
2amino4(3((4chlorophenoxy)methyl)4methoxyphenyl)4a567tetrahydronaphthalene133(4H)tricarbonitrile
445031561
COC1=C(C=C(C=C1)C2C3CCCC=C3C(=C(C2(C#N)C#N)N)C#N)COC4=CC=C(C=C4)Cl
InChI=1SC27H23ClN4O2c1332411617(1218(24)1434209719(28)81020)2522532421(22)23(1329)26(32)27(251530)1631h46122225H2351432H21H3
MFCD02175645
ZINC000002768397
ZINC000002768400
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