Vitas-M small molecule compound
4-{(1E)-3-[(3-chlorophenyl)amino]-2-cyano-3-oxoprop-1-en-1-yl}phenyl 4-methylbenzoate
Catalog ID
STK949815
SMILES N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)C)/C(=O)Nc1cccc(c1)Cl
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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 C24H17ClN2O3 MW 416.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17ClN2O3/c1-16-5-9-18(10-6-16)24(29)30-22-11-7-17(8-12-22)13-19(15-26)23(28)27-21-4-2-3-20(25)14-21/h2-14H,1H3,(H,27,28)/b19-13+InChIKey
WOPYHTXZXKSELC-CPNJWEJPSA-NSynonyms
(4((E)3(3chloroanilino)2cyano3oxoprop1enyl)phenyl)4methylbenzoate
4((1E)2(N(3CHLOROPHENYL)CARBAMOYL)2CYANOVINYL)PHENYL4METHYLBENZOATE
4((1E)3((3chlorophenyl)amino)2cyano3oxoprop1en1yl)phenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC(=CC=C3)Cl
InChI=1SC24H17ClN2O3c1165918(10616)24(29)302211717(81222)1319(1526)23(28)272142320(25)1421h214H1H3(H2728)b1913+
MFCD02364648
N#CC(=Cc1ccc(cc1)OC(=O)c1ccc(cc1)C)C(=O)Nc1cccc(c1)Cl
ZINC000000948749
ZINC00948749
ZINC948749
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