Vitas-M small molecule compound
N-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]thiophene-2-carboxamide
Catalog ID
STL533571
SMILES COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)NC(=O)c1cccs1)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 C26H26N2O6S MW 494.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O6S/c1-14(29)27-18-9-7-15-12-21(32-2)24(33-3)25(34-4)23(15)16-8-10-19(20(30)13-17(16)18)28-26(31)22-6-5-11-35-22/h5-6,8,10-13,18H,7,9H2,1-4H3,(H,27,29)(H,28,30,31)/t18-/m0/s1InChIKey
IRFCBDQWFPHHHU-SFHVURJKSA-NSynonyms
1212350-05-4(S)N(7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)thiophene2carboxamide
~(N)((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)thiophene2carboxamide
1212350054
16405634
COc1cc2CC(C@@H)(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NC(=O)c1cccs1)NC(=O)C
InChI=1SC26H26N2O6Sc114(29)271897151221(322)24(333)25(344)23(15)1681019(20(30)1317(16)18)2826(31)2265113522h568101318H79H214H3(H2729)(H283031)t18m0s1
MFCD08002424
N((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)thiophene2carboxamide
ZINC000008791827
ZINC8791827
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