Vitas-M small molecule compound
3,4-dimethylcyclohexyl 4-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-4-oxobutanoate
Catalog ID
STK775207
SMILES CCOc1ccc2c(c1)sc(n2)NC(=O)CCC(=O)OC1CCC(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 C21H28N2O4S MW 404.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O4S/c1-4-26-15-7-8-17-18(12-15)28-21(22-17)23-19(24)9-10-20(25)27-16-6-5-13(2)14(3)11-16/h7-8,12-14,16H,4-6,9-11H2,1-3H3,(H,22,23,24)InChIKey
HPDUZEAHPLHGLC-UHFFFAOYSA-NSynonyms
(34DIMETHYLCYCLOHEXYL)4((6ETHOXY13BENZOTHIAZOL2YL)AMINO)4OXOBUTANOATE
34dimethylcyclohexyl4((6ethoxy13benzothiazol2yl)amino)4oxobutanoate
CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCC(=O)OC3CCC(C(C3)C)C
InChI=1SC21H28N2O4Sc142615781718(1215)2821(2217)2319(24)91020(25)27166513(2)14(3)1116h78121416H46911H213H3(H222324)
MFCD05256908
ZINC000004112023
ZINC000015318852
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