Vitas-M small molecule compound
5,5-dimethyl-2-{[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene}cyclohexane-1,3-dione
Catalog ID
STK898841
SMILES Cc1ccc2c(c1)sc(n2)NC=C1C(=O)CC(CC1=O)(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 C17H18N2O2S MW 314.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N2O2S/c1-10-4-5-12-15(6-10)22-16(19-12)18-9-11-13(20)7-17(2,3)8-14(11)21/h4-6,9H,7-8H2,1-3H3,(H,18,19)InChIKey
MJVUKNJBGJKQSL-UHFFFAOYSA-NSynonyms
55dimethyl2(((6methyl13benzothiazol2yl)amino)methylidene)cyclohexane13dione
CC1=CC2=C(C=C1)N=C(S2)NC=C3C(=O)CC(CC3=O)(C)C
InChI=1SC17H18N2O2Sc110451215(610)2216(1912)1891113(20)717(23)814(11)21h469H78H213H3(H1819)
MFCD09039926
ZINC000013999575
ZINC13999575
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