Vitas-M small molecule compound

(7S)-N-{(2S)-1-[(2-chloro-6-fluorobenzyl)amino]-1-oxopropan-2-yl}-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide

Catalog ID
STL532000
SMILES O=C([C@@H](NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)C)NCc1c(F)cccc1Cl

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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 C29H24ClFN4O3 MW 530.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClFN4O3/c1-15(27(36)32-14-20-21(30)10-6-11-22(20)31)33-28(37)24-13-19-16-7-4-5-12-23(16)34-25(19)26-17-8-2-3-9-18(17)29(38)35(24)26/h2-12,15,24,26,34H,13-14H2,1H3,(H,32,36)(H,33,37)/t15-,24-,26?/m0/s1
InChIKey
ZCBIOYOGFXHOAY-SJHVFUEKSA-N
Synonyms
957023-90-4
(11~(S))~(N)((2~(S))1((2chloro6fluorophenyl)methylamino)1oxopropan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1((2chloro6fluorobenzyl)amino)1oxopropan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((2chloro6fluorobenzyl)amino)1oxopropan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16405370
957023904
InChI=1SC29H24ClFN4O3c115(27(36)32142021(30)1061122(20)31)3328(37)241319167451223(16)3425(19)2617823918(17)29(38)35(24)26h21215242634H1314H21H3(H3236)(H3337)t152426?m0s1
MFCD06770250
O=C((C@@H)(NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)C)NCc1c(F)cccc1Cl
ZINC000070704431
ZINC000070704434

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Available files

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