Vitas-M small molecule compound
5,5-dimethyl-3-{[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino}cyclohex-2-en-1-one
Catalog ID
STL357463
SMILES O=C1C=C(Nc2ccc(cc2)c2nc3c(s2)cc(cc3)C)CC(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 C22H22N2OS MW 362.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2OS/c1-14-4-9-19-20(10-14)26-21(24-19)15-5-7-16(8-6-15)23-17-11-18(25)13-22(2,3)12-17/h4-11,23H,12-13H2,1-3H3InChIKey
HYNNHXNLMFHTQW-UHFFFAOYSA-NSynonyms
337341-70-5337341705
55dimethyl3((4(6methyl13benzothiazol2yl)phenyl)amino)cyclohex2en1one
55dimethyl3((4(6methylbenzo(d)thiazol2yl)phenyl)amino)cyclohex2enone
55DIMETHYL3((4(6METHYLBENZOTHIAZOL2YL)PHENYL)AMINO)CYCLOHEX2EN1ONE
55DIMETHYL3(4(6METHYL13BENZOTHIAZOL2YL)ANILINO)CYCLOHEX2EN1ONE
55DIMETHYL3(4(6METHYLBENZOTHIAZOL2YL)PHENYLAMINO)CYCLOHEX2ENONE
CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC4=CC(=O)CC(C4)(C)C
InChI=1SC22H22N2OSc114491920(1014)2621(2419)155716(8615)23171118(25)1322(23)1217h41123H1213H213H3
MFCD01811096
ZINC000004793775
ZINC04793775
ZINC4793775
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