Vitas-M small molecule compound
(E)-N~2~-[7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2(3H)-ylidene)glycinamide
Catalog ID
STL542330
SMILES COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1C(CC2)NC(=O)C)NCC(=O)/N=c\1/sc2c([nH]1)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 C30H34N4O6S MW 578.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O6S/c1-16(35)32-20-11-9-17-13-24(38-2)28(39-3)29(40-4)27(17)18-10-12-21(23(36)14-19(18)20)31-15-26(37)34-30-33-22-7-5-6-8-25(22)41-30/h10,12-14,20H,5-9,11,15H2,1-4H3,(H,31,36)(H,32,35)(H,33,34,37)InChIKey
QWKUVCSKODAGDQ-UHFFFAOYSA-NSynonyms
(E)N~2~(7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(4567tetrahydro13benzothiazol2(3H)ylidene)glycinamide
2((7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(4567tetrahydro13benzothiazol2yl)acetamide
75357069
InChI=1SC30H34N4O6Sc116(35)3220119171324(382)28(393)29(404)27(17)18101221(23(36)1419(18)20)311526(37)34303322756825(22)4130h10121420H591115H214H3(H3136)(H3235)(H333437)
MFCD31755589
ZINC000108449698
ZINC000206253085
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