Vitas-M small molecule compound

(7S)-N-[(2S)-1-(benzylamino)-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
STL532392
SMILES CC([C@@H](C(=O)NCc1ccccc1)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 C31H30N4O3 MW 506.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O3/c1-18(2)26(30(37)32-17-19-10-4-3-5-11-19)34-29(36)25-16-23-20-12-8-9-15-24(20)33-27(23)28-21-13-6-7-14-22(21)31(38)35(25)28/h3-15,18,25-26,28,33H,16-17H2,1-2H3,(H,32,37)(H,34,36)/t25-,26-,28?/m0/s1
InChIKey
KKCQOKBFNYMQLR-QIELNMHASA-N
Synonyms
956817-98-4
(11~(S))~(N)((2~(S))1(benzylamino)3methyl1oxobutan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1(benzylamino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1(benzylamino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16406146
956817984
CC((C@@H)(C(=O)NCc1ccccc1)NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)C
InChI=1SC31H30N4O3c118(2)26(30(37)321719104351119)3429(36)2516232012891524(20)3327(23)282113671422(21)31(38)35(25)28h3151825262833H1617H212H3(H3237)(H3436)t252628?m0s1
MFCD07637472
ZINC000012889142
ZINC000012889148

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Available files

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