Vitas-M small molecule compound
(2E)-3-[(3-butoxyphenyl)amino]-2-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK527841
SMILES CCCCOc1cccc(c1)N/C=C(/c1scc(n1)c1cc2ccccc2oc1=O)\C#N
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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 C25H21N3O3S MW 443.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O3S/c1-2-3-11-30-20-9-6-8-19(13-20)27-15-18(14-26)24-28-22(16-32-24)21-12-17-7-4-5-10-23(17)31-25(21)29/h4-10,12-13,15-16,27H,2-3,11H2,1H3/b18-15+InChIKey
HFUKTYQEBIZBMF-OBGWFSINSA-NSynonyms
342377-22-4(2E)3((3butoxyphenyl)amino)2(4(2oxo2Hchromen3yl)13thiazol2yl)prop2enenitrile
(E)3((3butoxyphenyl)amino)2(4(2oxo2Hchromen3yl)thiazol2yl)acrylonitrile
(E)3(3BUTOXYANILINO)2(4(2OXOCHROMEN3YL)13THIAZOL2YL)PROP2ENENITRILE
342377224
CCCCOC1=CC=CC(=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=CC=CC=C4OC3=O
CCCCOc1cccc(c1)NC=C(c1scc(n1)c1cc2ccccc2oc1=O)C#N
InChI=1SC25H21N3O3Sc12311302096819(1320)271518(1426)242822(163224)2112177451023(17)3125(21)29h4101213151627H2311H21H3b1815+
MFCD01948364
ZINC000009327491
ZINC09327491
ZINC9327491
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