Vitas-M small molecule compound
4-[(E)-2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]phenyl 4-chlorobenzoate
Catalog ID
STK381454
SMILES N#C/C(=C\c1ccc(cc1)OC(=O)c1ccc(cc1)Cl)/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 C23H13ClN2O2S MW 416.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H13ClN2O2S/c24-18-9-7-16(8-10-18)23(27)28-19-11-5-15(6-12-19)13-17(14-25)22-26-20-3-1-2-4-21(20)29-22/h1-13H/b17-13+InChIKey
UJDRQNZDXREOBS-GHRIWEEISA-NSynonyms
476358-46-0(4((E)2(13BENZOTHIAZOL2YL)2CYANOETHENYL)PHENYL)4CHLOROBENZOATE
4((E)2(13benzothiazol2yl)2cyanoethenyl)phenyl4chlorobenzoate
476358460
C1=CC=C2C(=C1)N=C(S2)C(=CC3=CC=C(C=C3)OC(=O)C4=CC=C(C=C4)Cl)C#N
InChI=1SC23H13ClN2O2Sc24189716(81018)23(27)281911515(61219)1317(1425)222620312421(20)2922h113Hb1713+
MFCD02915046
N#CC(=Cc1ccc(cc1)OC(=O)c1ccc(cc1)Cl)c1nc2c(s1)cccc2
ZINC000008721977
ZINC08721977
ZINC8721977
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