Vitas-M small molecule compound
propan-2-yl 4-{5-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]furan-2-yl}benzoate
Catalog ID
STL330123
SMILES N#C/C(=C\c1ccc(o1)c1ccc(cc1)C(=O)OC(C)C)/c1nc2c(s1)cccc2
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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 C24H18N2O3S MW 414.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18N2O3S/c1-15(2)28-24(27)17-9-7-16(8-10-17)21-12-11-19(29-21)13-18(14-25)23-26-20-5-3-4-6-22(20)30-23/h3-13,15H,1-2H3/b18-13+InChIKey
BUKJYUMATJEGFW-QGOAFFKASA-NSynonyms
(E)isopropyl4(5(2(benzo(d)thiazol2yl)2cyanovinyl)furan2yl)benzoate
CC(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C(C#N)C3=NC4=CC=CC=C4S3
InChI=1SC24H18N2O3Sc115(2)2824(27)179716(81017)21121119(2921)1318(1425)232620534622(20)3023h31315H12H3b1813+
METHYLETHYL4(5((1E)2BENZOTHIAZOL2YL2CYANOVINYL)2FURYL)BENZOATE
MFCD01648899
N#CC(=Cc1ccc(o1)c1ccc(cc1)C(=O)OC(C)C)c1nc2c(s1)cccc2
propan2yl4(5((E)2(13benzothiazol2yl)2cyanoethenyl)furan2yl)benzoate
ZINC000004857941
ZINC04857941
ZINC4857941
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