Vitas-M small molecule compound
4-tert-butylcyclohexyl 4-(1,3-benzothiazol-2-ylamino)-4-oxobutanoate
Catalog ID
STK723454
SMILES O=C(OC1CCC(CC1)C(C)(C)C)CCC(=O)Nc1nc2c(s1)cccc2
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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 C21H28N2O3S MW 388.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2O3S/c1-21(2,3)14-8-10-15(11-9-14)26-19(25)13-12-18(24)23-20-22-16-6-4-5-7-17(16)27-20/h4-7,14-15H,8-13H2,1-3H3,(H,22,23,24)InChIKey
AXRGCFGEBBFZFY-UHFFFAOYSA-NSynonyms
330835-78-4(4TERTBUTYLCYCLOHEXYL)4(13BENZOTHIAZOL2YLAMINO)4OXOBUTANOATE
330835784
4(tertbutyl)cyclohexyl4(benzo(d)thiazol2ylamino)4oxobutanoate
4tertbutylcyclohexyl4(13benzothiazol2ylamino)4oxobutanoate
CC(C)(C)C1CCC(CC1)OC(=O)CCC(=O)NC2=NC3=CC=CC=C3S2
InChI=1SC21H28N2O3Sc121(23)1481015(11914)2619(25)131218(24)23202216645717(16)2720h471415H813H213H3(H222324)
MFCD00819603
NBENZOTHIAZOL2YLSUCCINAMICACID4TERTBUTYLCYCLOHEXYLESTER
ZINC000018069443
ZINC18069443
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