Vitas-M small molecule compound
(2E)-3-(4-benzylpiperazin-1-yl)-2-[(3,4-dimethylphenyl)sulfonyl]prop-2-enenitrile
Catalog ID
STK829087
SMILES N#C/C(=C\N1CCN(CC1)Cc1ccccc1)/S(=O)(=O)c1ccc(c(c1)C)C
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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 C22H25N3O2S MW 395.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O2S/c1-18-8-9-21(14-19(18)2)28(26,27)22(15-23)17-25-12-10-24(11-13-25)16-20-6-4-3-5-7-20/h3-9,14,17H,10-13,16H2,1-2H3/b22-17+InChIKey
BXNYFZBWKCJWIB-OQKWZONESA-NSynonyms
885186-00-5(2E)3(4benzylpiperazin1yl)2((34dimethylphenyl)sulfonyl)prop2enenitrile
(E)3(4benzylpiperazin1yl)2((34dimethylphenyl)sulfonyl)acrylonitrile
(E)3(4BENZYLPIPERAZIN1YL)2(34DIMETHYLPHENYL)SULFONYLPROP2ENENITRILE
885186005
CC1=C(C=C(C=C1)S(=O)(=O)C(=CN2CCN(CC2)CC3=CC=CC=C3)C#N)C
InChI=1SC22H25N3O2Sc1188921(1419(18)2)28(2627)22(1523)1725121024(111325)16206435720h391417H101316H212H3b2217+
MFCD07643072
N#CC(=CN1CCN(CC1)Cc1ccccc1)S(=O)(=O)c1ccc(c(c1)C)C
ZINC000020403647
ZINC20403647
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