Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)prop-2-enenitrile
Catalog ID
STK557664
SMILES N#C/C(=C\Nc1ccc2c(c1)OCCO2)/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 C18H13N3O2S MW 335.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O2S/c19-10-12(18-21-14-3-1-2-4-17(14)24-18)11-20-13-5-6-15-16(9-13)23-8-7-22-15/h1-6,9,11,20H,7-8H2/b12-11+InChIKey
QKJWLOOZLPEIPJ-VAWYXSNFSA-NSynonyms
577787-17-8(2E)2(13benzothiazol2yl)3(23dihydro14benzodioxin6ylamino)prop2enenitrile
(2E)3(2H3HBENZO(34E)14DIOXIN6YLAMINO)2BENZOTHIAZOL2YLPROP2ENENITRILE
(E)2(13BENZOTHIAZOL2YL)3(23DIHYDRO14BENZODIOXIN6YLAMINO)PROP2ENENITRILE
(E)2(benzo(d)thiazol2yl)3((23dihydrobenzo(b)(14)dioxin6yl)amino)acrylonitrile
577787178
C1COC2=C(O1)C=CC(=C2)NC=C(C#N)C3=NC4=CC=CC=C4S3
InChI=1SC18H13N3O2Sc191012(182114312417(14)2418)112013561516(913)23872215h1691120H78H2b1211+
MFCD04026989
N#CC(=CNc1ccc2c(c1)OCCO2)c1nc2c(s1)cccc2
ZINC000000531685
ZINC00531685
ZINC531685
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