Vitas-M small molecule compound
(7S)-N-[(2S)-1-{[2-(3-fluorophenyl)ethyl]amino}-4-methyl-1-oxopentan-2-yl]-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide
Catalog ID
STL531740
SMILES Fc1cccc(c1)CCNC(=O)[C@@H](NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)CC(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 C33H33FN4O3 MW 552.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33FN4O3/c1-19(2)16-27(31(39)35-15-14-20-8-7-9-21(34)17-20)37-32(40)28-18-25-22-10-5-6-13-26(22)36-29(25)30-23-11-3-4-12-24(23)33(41)38(28)30/h3-13,17,19,27-28,30,36H,14-16,18H2,1-2H3,(H,35,39)(H,37,40)/t27-,28-,30?/m0/s1InChIKey
BLVJRVFZASSPHT-SRBHEWTHSA-NSynonyms
956158-22-8(11~(S))~(N)((2~(S))1(2(3fluorophenyl)ethylamino)4methyl1oxopentan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1((2(3fluorophenyl)ethyl)amino)4methyl1oxopentan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((3fluorophenethyl)amino)4methyl1oxopentan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16405406
956158228
Fc1cccc(c1)CCNC(=O)(C@@H)(NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)CC(C)C
InChI=1SC33H33FN4O3c119(2)1627(31(39)3515142087921(34)1720)3732(40)2818252210561326(22)3629(25)302311341224(23)33(41)38(28)30h313171927283036H141618H212H3(H3539)(H3740)t272830?m0s1
MFCD06770491
ZINC000070704505
ZINC000070704508
Check stock
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Check stock on Vitas-MAvailable files
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