Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile
Catalog ID
STK888788
SMILES N#C/C(=C\c1cccc(c1)[N+](=O)[O-])/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 C16H9N3O2S MW 307.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9N3O2S/c17-10-12(8-11-4-3-5-13(9-11)19(20)21)16-18-14-6-1-2-7-15(14)22-16/h1-9H/b12-8+InChIKey
TULRHJPZXFYARJ-XYOKQWHBSA-NSynonyms
131468-74-1(2E)2(13benzothiazol2yl)3(3nitrophenyl)prop2enenitrile
(2E)2BENZOTHIAZOL2YL3(3NITROPHENYL)PROP2ENENITRILE
(E)2(13BENZOTHIAZOL2YL)3(3NITROPHENYL)PROP2ENENITRILE
(E)2BENZOTHIAZOL2YL3(3NITROPHENYL)ACRYLONITRILE
(Z)2(benzo(d)thiazol2yl)3(3nitrophenyl)acrylonitrile
131468741
C1=CC=C2C(=C1)N=C(S2)C(=CC3=CC(=CC=C3)(N+)(=O)(O))C#N
InChI=1SC16H9N3O2Sc171012(81143513(911)19(20)21)161814612715(14)2216h19Hb128+
MFCD00638439
N#CC(=Cc1cccc(c1)(N+)(=O)(O))c1nc2c(s1)cccc2
ZINC000004247270
ZINC04247270
ZINC4247270
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