Vitas-M small molecule compound
(7S)-N-[(2S)-1-[(4-methylbenzyl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide
Catalog ID
STL532591
SMILES CSCC[C@@H](C(=O)NCc1ccc(cc1)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 C32H32N4O3S MW 552.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H32N4O3S/c1-19-11-13-20(14-12-19)18-33-30(37)26(15-16-40-2)35-31(38)27-17-24-21-7-5-6-10-25(21)34-28(24)29-22-8-3-4-9-23(22)32(39)36(27)29/h3-14,26-27,29,34H,15-18H2,1-2H3,(H,33,37)(H,35,38)/t26-,27-,29?/m0/s1InChIKey
NMKJUIHPJMMBRO-DARYULOESA-NSynonyms
957030-78-3(11~(S))~(N)((2~(S))1((4methylphenyl)methylamino)4methylsulfanyl1oxobutan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1((4methylbenzyl)amino)4(methylsulfanyl)1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((4methylbenzyl)amino)4(methylthio)1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16406005
957030783
CSCC(C@@H)(C(=O)NCc1ccc(cc1)C)NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1
InChI=1SC32H32N4O3Sc119111320(141219)183330(37)26(1516402)3531(38)271724217561025(21)3428(24)2922834923(22)32(39)36(27)29h31426272934H1518H212H3(H3337)(H3538)t262729?m0s1
MFCD07208289
ZINC000070706573
ZINC000070706576
Check stock
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Check stock on Vitas-MAvailable files
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