Vitas-M small molecule compound
4-{(1E)-2-cyano-3-[(4-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}phenyl 4-methylbenzoate
Catalog ID
STK899485
SMILES N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)C)/C(=O)Nc1ccc(cc1)F
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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 C24H17FN2O3 MW 400.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17FN2O3/c1-16-2-6-18(7-3-16)24(29)30-22-12-4-17(5-13-22)14-19(15-26)23(28)27-21-10-8-20(25)9-11-21/h2-14H,1H3,(H,27,28)/b19-14+InChIKey
LEBDYBQZMVSTKT-XMHGGMMESA-NSynonyms
(4((E)2cyano3(4fluoroanilino)3oxoprop1enyl)phenyl)4methylbenzoate
4((1E)2CYANO2(N(4FLUOROPHENYL)CARBAMOYL)VINYL)PHENYL4METHYLBENZOATE
4((1E)2cyano3((4fluorophenyl)amino)3oxoprop1en1yl)phenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=C(C=C3)F
InChI=1SC24H17FN2O3c1162618(7316)24(29)302212417(51322)1419(1526)23(28)272110820(25)91121h214H1H3(H2728)b1914+
MFCD02364659
N#CC(=Cc1ccc(cc1)OC(=O)c1ccc(cc1)C)C(=O)Nc1ccc(cc1)F
ZINC000000948757
ZINC00948757
ZINC948757
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