Vitas-M small molecule compound
N-{(7S)-10-[(4-fluorophenyl)amino]-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide
Catalog ID
STL531337
SMILES COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)Nc1ccc(cc1)F)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 C27H27FN2O5 MW 478.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27FN2O5/c1-15(31)29-21-11-5-16-13-24(33-2)26(34-3)27(35-4)25(16)19-10-12-22(23(32)14-20(19)21)30-18-8-6-17(28)7-9-18/h6-10,12-14,21H,5,11H2,1-4H3,(H,29,31)(H,30,32)/t21-/m0/s1InChIKey
FHEGKVYINMDMFJ-NRFANRHFSA-NSynonyms
1212414-86-2(S)N(10((4fluorophenyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
~(N)((7~(S))10(4fluoroanilino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1212414862
16404926
COc1cc2CC(C@@H)(c3c(c2c(c1OC)OC)ccc(c(=O)c3)Nc1ccc(cc1)F)NC(=O)C
InChI=1SC27H27FN2O5c115(31)2921115161324(332)26(343)27(354)25(16)19101222(23(32)1420(19)21)30188617(28)7918h610121421H511H214H3(H2931)(H3032)t21m0s1
MFCD06768470
N((7S)10((4fluorophenyl)amino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000012885580
ZINC12885580
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