Vitas-M small molecule compound

(7S)-N-{(2S)-1-[(4-chlorobenzyl)amino]-3-methyl-1-oxobutan-2-yl}-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide

Catalog ID
STL530189
SMILES Clc1ccc(cc1)CNC(=O)[C@H](C(C)C)NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1

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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 C31H29ClN4O3 MW 541.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29ClN4O3/c1-17(2)26(30(38)33-16-18-11-13-19(32)14-12-18)35-29(37)25-15-23-20-7-5-6-10-24(20)34-27(23)28-21-8-3-4-9-22(21)31(39)36(25)28/h3-14,17,25-26,28,34H,15-16H2,1-2H3,(H,33,38)(H,35,37)/t25-,26-,28?/m0/s1
InChIKey
MLVDUYSTMFMLEP-QIELNMHASA-N
Synonyms
956820-20-5
(11~(S))~(N)((2~(S))1((4chlorophenyl)methylamino)3methyl1oxobutan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1((4chlorobenzyl)amino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((4chlorobenzyl)amino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16405144
956820205
Clc1ccc(cc1)CNC(=O)(C@H)(C(C)C)NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1
InChI=1SC31H29ClN4O3c117(2)26(30(38)331618111319(32)141218)3529(37)251523207561024(20)3427(23)2821834922(21)31(39)36(25)28h3141725262834H1516H212H3(H3338)(H3537)t252628?m0s1
MFCD07636954
ZINC000070701427
ZINC000070701429

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Available files

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