Vitas-M small molecule compound
(2Z)-[4-amino-3-(4-butylphenyl)-1,3-thiazol-2(3H)-ylidene](phenylsulfonyl)ethanenitrile
Catalog ID
STK149812
SMILES CCCCc1ccc(cc1)n1c(N)cs/c/1=C(\S(=O)(=O)c1ccccc1)/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 C21H21N3O2S2 MW 411.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O2S2/c1-2-3-7-16-10-12-17(13-11-16)24-20(23)15-27-21(24)19(14-22)28(25,26)18-8-5-4-6-9-18/h4-6,8-13,15H,2-3,7,23H2,1H3/b21-19-InChIKey
AEXBRJJOLGKLLG-VZCXRCSSSA-NSynonyms
(2Z)(4AMINO3(4BUTYLPHENYL)13THIAZOL2(3H)YLIDENE)(PHENYLSULFONYL)ETHANENITRILE
(2Z)2(4AMINO3(4BUTYLPHENYL)13THIAZOL2YLIDENE)2(BENZENESULFONYL)ACETONITRILE
2(4AMINO3(4BUTYLPHENYL)(13THIAZOLIN2YLIDENE))2(PHENYLSULFONYL)ETHANENITRILE
CCCCC1=CC=C(C=C1)N2C(=CSC2=C(C#N)S(=O)(=O)C3=CC=CC=C3)N
CCCCc1ccc(cc1)n1c(N)csc1=C(S(=O)(=O)c1ccccc1)C#N
InChI=1SC21H21N3O2S2c123716101217(131116)2420(23)152721(24)19(1422)28(2526)188546918h4681315H23723H21H3b2119
MFCD04190736
ZINC000018156407
ZINC18156407
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