Vitas-M small molecule compound
propan-2-yl 4-({(E)-2-[4-(6-chloro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-2-cyanoethenyl}amino)benzoate
Catalog ID
STK878551
SMILES N#C/C(=C\Nc1ccc(cc1)C(=O)OC(C)C)/c1scc(n1)c1cc2cc(Cl)ccc2oc1=O
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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 C25H18ClN3O4S MW 491.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClN3O4S/c1-14(2)32-24(30)15-3-6-19(7-4-15)28-12-17(11-27)23-29-21(13-34-23)20-10-16-9-18(26)5-8-22(16)33-25(20)31/h3-10,12-14,28H,1-2H3/b17-12+InChIKey
RLFIDXQVQXVWTA-SFQUDFHCSA-NSynonyms
1021231-21-91021231219
CC(C)OC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)Cl)OC3=O
InChI=1SC25H18ClN3O4Sc114(2)3224(30)153619(7415)281217(1127)232921(133423)201016918(26)5822(16)3325(20)31h310121428H12H3b1712+
MFCD11992901
N#CC(=CNc1ccc(cc1)C(=O)OC(C)C)c1scc(n1)c1cc2cc(Cl)ccc2oc1=O
propan2yl4(((E)2(4(6chloro2oxo2Hchromen3yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
propan2yl4(((E)2(4(6chloro2oxochromen3yl)13thiazol2yl)2cyanoethenyl)amino)benzoate
ZINC000017113483
ZINC17113483
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