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N-[(7S)-1,2,3-trimethoxy-10-{[(2S)-3-methyl-1-oxo-1-(thiomorpholin-4-yl)pentan-2-yl]amino}-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide

Catalog ID
STL542001
SMILES CC[C@H]([C@@H](C(=O)N1CCSCC1)Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)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 C31H41N3O6S MW 583.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H41N3O6S/c1-7-18(2)28(31(37)34-12-14-41-15-13-34)33-24-11-9-21-22(17-25(24)36)23(32-19(3)35)10-8-20-16-26(38-4)29(39-5)30(40-6)27(20)21/h9,11,16-18,23,28H,7-8,10,12-15H2,1-6H3,(H,32,35)(H,33,36)/t18-,23+,28+/m1/s1
InChIKey
ZIGHQIPNUWSDGJ-CLAHJSNCSA-N
Synonyms
1574353-39-1
~(N)((7~(S))123trimethoxy10(((2~(S)3~(R))3methyl1oxo1thiomorpholin4ylpentan2yl)amino)9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1574353391
75491022
CC(C@H)((C@@H)(C(=O)N1CCSCC1)Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC31H41N3O6Sc1718(2)28(31(37)34121441151334)33241192122(1725(24)36)23(3219(3)35)108201626(384)29(395)30(406)27(20)21h91116182328H78101215H216H3(H3235)(H3336)t1823+28+m1s1
N((7S)123trimethoxy10(((2S)3methyl1oxo1(thiomorpholin4yl)pentan2yl)amino)9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
N((S)123trimethoxy10(((2S3R)3methyl1oxo1thiomorpholinopentan2yl)amino)9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000108447481
ZINC108447481

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Available files

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