Vitas-M small molecule compound
(1S,5S)-N-[(2S)-1-[(9-ethyl-9H-carbazol-3-yl)amino]-4-(methylsulfanyl)-1-oxobutan-2-yl]-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide
Catalog ID
STL537116
SMILES CSCC[C@@H](C(=O)Nc1ccc2c(c1)c1ccccc1n2CC)NC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C31H35N5O3S MW 557.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35N5O3S/c1-3-35-27-8-5-4-7-23(27)24-16-22(11-12-28(24)35)32-30(38)25(13-14-40-2)33-31(39)34-17-20-15-21(19-34)26-9-6-10-29(37)36(26)18-20/h4-12,16,20-21,25H,3,13-15,17-19H2,1-2H3,(H,32,38)(H,33,39)/t20-,21+,25-/m0/s1InChIKey
YMXFPSAOPVBHIN-BKSPAHHJSA-NSynonyms
(1R5R)N((S)1((9ethyl9Hcarbazol3yl)amino)4(methylthio)1oxobutan2yl)8oxo4568tetrahydro1H15methanopyrido(12a)(15)diazocine3(2H)carboxamide
(1S5S)N((2S)1((9ethyl9Hcarbazol3yl)amino)4(methylsulfanyl)1oxobutan2yl)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocine3(4H)carboxamide
CSCC(C@@H)(C(=O)Nc1ccc2c(c1)c1ccccc1n2CC)NC(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC31H35N5O3Sc133527854723(27)241622(111228(24)35)3230(38)25(1314402)3331(39)3417201521(1934)26961029(37)36(26)1820h41216202125H313151719H212H3(H3238)(H3339)t2021+25m0s1
MFCD07202618
ZINC000002095684
Check stock
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