Vitas-M small molecule compound
2-amino-4-{5-[(4-chloro-2-methylphenoxy)methyl]-2,4-dimethylphenyl}-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
Catalog ID
STK956051
SMILES N#CC1=C(N)C(C(C2C1=CCCC2)c1cc(COc2ccc(cc2C)Cl)c(cc1C)C)(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 C29H27ClN4O MW 483.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN4O/c1-17-10-18(2)24(12-20(17)14-35-26-9-8-21(30)11-19(26)3)27-23-7-5-4-6-22(23)25(13-31)28(34)29(27,15-32)16-33/h6,8-12,23,27H,4-5,7,14,34H2,1-3H3InChIKey
FCYUMVYYYLEQEL-UHFFFAOYSA-NSynonyms
438216-80-92AMINO4(5((4CHLORO2METHYLPHENOXY)METHYL)24DIMETHYLPHENYL)4A567TETRAHYDRO133(4H)NAPHTHALENETRICARBONITRILE
2AMINO4(5((4CHLORO2METHYLPHENOXY)METHYL)24DIMETHYLPHENYL)4A567TETRAHYDRO4HNAPHTHALENE133TRICARBONITRILE
2amino4(5((4chloro2methylphenoxy)methyl)24dimethylphenyl)4a567tetrahydronaphthalene133(4H)tricarbonitrile
438216809
CC1=CC(=C(C=C1C2C3CCCC=C3C(=C(C2(C#N)C#N)N)C#N)COC4=C(C=C(C=C4)Cl)C)C
InChI=1SC29H27ClN4Oc1171018(2)24(1220(17)1435269821(30)1119(26)3)2723754622(23)25(1331)28(34)29(271532)1633h68122327H4571434H213H3
MFCD03074208
ZINC000000650682
ZINC000000650686
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