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4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-[3,5-dimethyl-1-(propan-2-yl)-1H-pyrazol-4-yl]butanamide

Catalog ID
STL544615
SMILES COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCC(=O)Nc1c(C)nn(c1C)C(C)C)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 C33H43N5O6 MW 605.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H43N5O6/c1-18(2)38-20(4)31(19(3)37-38)36-29(41)10-9-15-34-26-14-12-23-24(17-27(26)40)25(35-21(5)39)13-11-22-16-28(42-6)32(43-7)33(44-8)30(22)23/h12,14,16-18,25H,9-11,13,15H2,1-8H3,(H,34,40)(H,35,39)(H,36,41)/t25-/m0/s1
InChIKey
YUHXKRQEBZLLDF-VWLOTQADSA-N
Synonyms
1574352-70-7
(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(1isopropyl35dimethyl1Hpyrazol4yl)butanamide
1574352707
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(35dimethyl1propan2ylpyrazol4yl)butanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(35dimethyl1(propan2yl)1Hpyrazol4yl)butanamide
75492209
COc1cc2CC(C@@H)(c3c(c2c(c1OC)OC)ccc(c(=O)c3)NCCCC(=O)Nc1c(C)nn(c1C)C(C)C)NC(=O)C
InChI=1SC33H43N5O6c118(2)3820(4)31(19(3)3738)3629(41)10915342614122324(1727(26)40)25(3521(5)39)1311221628(426)32(437)33(448)30(22)23h1214161825H9111315H218H3(H3440)(H3539)(H3641)t25m0s1
ZINC000108450538
ZINC108450538

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Available files

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