Vitas-M small molecule compound

(7S)-N-{(2S)-1-[(2-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
STL530011
SMILES CC([C@@H](C(=O)NCc1ccccc1Cl)NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)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 C31H29ClN4O3 MW 541.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29ClN4O3/c1-17(2)26(30(38)33-16-18-9-3-7-13-23(18)32)35-29(37)25-15-22-19-10-6-8-14-24(19)34-27(22)28-20-11-4-5-12-21(20)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
AXOGBZIZMIBXOZ-QIELNMHASA-N
Synonyms
957021-21-5
(11~(S))~(N)((2~(S))1((2chlorophenyl)methylamino)3methyl1oxobutan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1((2chlorobenzyl)amino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((2chlorobenzyl)amino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16404506
957021215
CC((C@@H)(C(=O)NCc1ccccc1Cl)NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)C
InChI=1SC31H29ClN4O3c117(2)26(30(38)3316189371323(18)32)3529(37)2515221910681424(19)3427(22)282011451221(20)31(39)36(25)28h3141725262834H1516H212H3(H3338)(H3537)t252628?m0s1
MFCD07636933
ZINC000070700701
ZINC000070700703

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Available files

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