Vitas-M small molecule compound
4-amino-2-(4-bromophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-2H-chromene-3-carbonitrile
Catalog ID
STK065803
SMILES N#CC1=C(N)C2=C(OC1c1ccc(cc1)Br)CC(CC2=O)(C)C
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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 C18H17BrN2O2 MW 373.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN2O2/c1-18(2)7-13(22)15-14(8-18)23-17(12(9-20)16(15)21)10-3-5-11(19)6-4-10/h3-6,17H,7-8,21H2,1-2H3InChIKey
JPMXUVCVQIIJKI-UHFFFAOYSA-NSynonyms
4amino2(4bromophenyl)77dimethyl5oxo5678tetrahydro2Hchromene3carbonitrile
4AMINO2(4BROMOPHENYL)77DIMETHYL5OXO68DIHYDRO2HCHROMENE3CARBONITRILE
CC1(CC2=C(C(=O)C1)C(=C(C(O2)C3=CC=C(C=C3)Br)C#N)N)C
InChI=1SC18H17BrN2O2c118(2)713(22)1514(818)2317(12(920)16(15)21)103511(19)6410h3617H7821H212H3
MFCD02232640
N#CC1=C(N)C2=C(OC1c1ccc(cc1)Br)CC(CC2=O)(C)C
STK065803
ZINC000005727687
ZINC000005727688
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