Vitas-M small molecule compound
(2E)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]-N-(1,3-thiazol-2-yl)prop-2-enamide
Catalog ID
STK473113
SMILES N#C/C(=C\c1c[nH]nc1c1ccc(c(c1)OC)OC)/C(=O)Nc1nccs1
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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 C18H15N5O3S MW 381.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15N5O3S/c1-25-14-4-3-11(8-15(14)26-2)16-13(10-21-23-16)7-12(9-19)17(24)22-18-20-5-6-27-18/h3-8,10H,1-2H3,(H,21,23)(H,20,22,24)/b12-7+InChIKey
HQNIMUHLHIFOAM-KPKJPENVSA-NSynonyms
(2E)2cyano3(3(34dimethoxyphenyl)1Hpyrazol4yl)N(13thiazol2yl)prop2enamide
(2E)3(3(34DIMETHOXYPHENYL)PYRAZOL4YL)2CYANON(13THIAZOL2YL)PROP2ENAMIDE
(E)2cyano3(5(34dimethoxyphenyl)1Hpyrazol4yl)N(13thiazol2yl)prop2enamide
COC1=C(C=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)NC3=NC=CS3)OC
InChI=1SC18H15N5O3Sc125144311(815(14)262)1613(10212316)712(919)17(24)221820562718h3810H12H3(H2123)(H202224)b127+
MFCD07092920
N#CC(=Cc1c(nH)nc1c1ccc(c(c1)OC)OC)C(=O)Nc1nccs1
ZINC000017077931
ZINC17077931
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