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N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[3-(1H-1,2,4-triazol-3-yl)phenyl]glycinamide

Catalog ID
STL544278
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCC(=O)Nc2cccc(c2)c2n[nH]cn2)NC(=O)C)cc(c1OC)OC

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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 C31H32N6O6 MW 584.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N6O6/c1-17(38)35-23-10-8-18-13-26(41-2)29(42-3)30(43-4)28(18)21-9-11-24(25(39)14-22(21)23)32-15-27(40)36-20-7-5-6-19(12-20)31-33-16-34-37-31/h5-7,9,11-14,16,23H,8,10,15H2,1-4H3,(H,32,39)(H,35,38)(H,36,40)(H,33,34,37)/t23-/m0/s1
InChIKey
LACYLJRDQKHEDI-QHCPKHFHSA-N
Synonyms
1630926-79-2
(S)N(3(1H124triazol3yl)phenyl)2((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)acetamide
1630926792
2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(3(1~(H)124triazol5yl)phenyl)acetamide
91638243
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCC(=O)Nc2cccc(c2)c2n(nH)cn2)NC(=O)C)cc(c1OC)OC
InChI=1SC31H32N6O6c117(38)3523108181326(412)29(423)30(434)28(18)2191124(25(39)1422(21)23)321527(40)362075619(1220)313316343731h57911141623H81015H214H3(H3239)(H3538)(H3640)(H333437)t23m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(3(1H124triazol3yl)phenyl)glycinamide
ZINC000217868233
ZINC217868233

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Available files

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