Vitas-M small molecule compound
2-amino-4-{4-[(2-cyanobenzyl)oxy]-3-methoxyphenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
Catalog ID
STL379692
SMILES N#CC1=C(N)OC2=C(C1c1ccc(c(c1)OC)OCc1ccccc1C#N)C(=O)CCC2
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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 C25H21N3O4 MW 427.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O4/c1-30-22-11-15(9-10-20(22)31-14-17-6-3-2-5-16(17)12-26)23-18(13-27)25(28)32-21-8-4-7-19(29)24(21)23/h2-3,5-6,9-11,23H,4,7-8,14,28H2,1H3InChIKey
GBMDUSOQTOAHBN-UHFFFAOYSA-NSynonyms
2amino4(4((2cyanobenzyl)oxy)3methoxyphenyl)5oxo5678tetrahydro4Hchromene3carbonitrile
2amino4(4((2cyanophenyl)methoxy)3methoxyphenyl)5oxo4678tetrahydrochromene3carbonitrile
2AMINO4(4((2CYANOPHENYL)METHOXY)3METHOXYPHENYL)5OXO4H678TRIHYDROCHROMENE3CARBONITRILE
COC1=C(C=CC(=C1)C2C(=C(OC3=C2C(=O)CCC3)N)C#N)OCC4=CC=CC=C4C#N
InChI=1SC25H21N3O4c130221115(91020(22)311417632516(17)1226)2318(1327)25(28)322184719(29)24(21)23h235691123H4781428H21H3
MFCD04091249
ZINC000000661065
ZINC000000661067
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