Vitas-M small molecule compound
6-{[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[(2Z)-4,5-dimethyl-1,3-thiazol-2(3H)-ylidene]hexanamide
Catalog ID
STL544725
SMILES COc1cc2CCC(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCCCC(=O)/N=c\1/[nH]c(c(s1)C)C)NC(=O)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 C32H40N4O6S MW 608.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H40N4O6S/c1-18-19(2)43-32(34-18)36-28(39)10-8-7-9-15-33-25-14-12-22-23(17-26(25)38)24(35-20(3)37)13-11-21-16-27(40-4)30(41-5)31(42-6)29(21)22/h12,14,16-17,24H,7-11,13,15H2,1-6H3,(H,33,38)(H,35,37)(H,34,36,39)InChIKey
ONUXHYYRDNVCFL-UHFFFAOYSA-NSynonyms
110209706
6((7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N((2Z)45dimethyl13thiazol2(3H)ylidene)hexanamide
6((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(45dimethyl13thiazol2yl)hexanamide
InChI=1SC32H40N4O6Sc11819(2)4332(3418)3628(39)1087915332514122223(1726(25)38)24(3520(3)37)1311211627(404)30(415)31(426)29(21)22h1214161724H7111315H216H3(H3338)(H3537)(H343639)
MFCD31756102
ZINC000108450707
ZINC000252539858
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