Vitas-M small molecule compound
[(2Z)-2-[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]-1,3-benzothiazol-3(2H)-yl]acetonitrile
Catalog ID
STL217867
SMILES N#CCn1/c(=C\2/N=C(OC2=O)c2ccc(cc2)C)/sc2c1cccc2
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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 C19H13N3O2S MW 347.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N3O2S/c1-12-6-8-13(9-7-12)17-21-16(19(23)24-17)18-22(11-10-20)14-4-2-3-5-15(14)25-18/h2-9H,11H2,1H3/b18-16-InChIKey
JBIAYRHVADRPES-VLGSPTGOSA-NSynonyms
((2Z)2(2(4methylphenyl)5oxo13oxazol4(5H)ylidene)13benzothiazol3(2H)yl)acetonitrile
2((2Z)2(2(4methylphenyl)5oxo13oxazol4ylidene)13benzothiazol3yl)acetonitrile
CC1=CC=C(C=C1)C2=NC(=C3N(C4=CC=CC=C4S3)CC#N)C(=O)O2
InChI=1SC19H13N3O2Sc1126813(9712)172116(19(23)2417)1822(111020)14423515(14)2518h29H11H21H3b1816
MFCD18081075
N#CCn1c(=C2N=C(OC2=O)c2ccc(cc2)C)sc2c1cccc2
ZINC000041154931
ZINC41154931
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