Vitas-M small molecule compound
(2E)-2-(1,3-benzothiazol-2-yl)-3-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile
Catalog ID
STL331188
SMILES N#C/C(=C\c1c(C)nn(c1Cl)c1ccccc1)/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 C20H13ClN4S MW 376.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13ClN4S/c1-13-16(19(21)25(24-13)15-7-3-2-4-8-15)11-14(12-22)20-23-17-9-5-6-10-18(17)26-20/h2-11H,1H3/b14-11+InChIKey
LCUHZCYFVGPRFI-SDNWHVSQSA-NSynonyms
1426342-60-0(2E)2(13benzothiazol2yl)3(5chloro3methyl1phenyl1Hpyrazol4yl)prop2enenitrile
(2E)2BENZOTHIAZOL2YL3(5CHLORO3METHYL1PHENYLPYRAZOL4YL)PROP2ENENITRILE
(E)2(13BENZOTHIAZOL2YL)3(5CHLORO3METHYL1PHENYLPYRAZOL4YL)PROP2ENENITRILE
(E)2(BENZO(D)THIAZOL2YL)3(5CHLORO3METHYL1PHENYL1HPYRAZOL4YL)ACRYLONITRILE
1426342600
CC1=NN(C(=C1C=C(C#N)C2=NC3=CC=CC=C3S2)Cl)C4=CC=CC=C4
InChI=1SC20H13ClN4Sc11316(19(21)25(2413)157324815)1114(1222)2023179561018(17)2620h211H1H3b1411+
MFCD02165919
N#CC(=Cc1c(C)nn(c1Cl)c1ccccc1)c1nc2c(s1)cccc2
ZINC000004040048
ZINC04040048
ZINC4040048
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