Vitas-M small molecule compound
S-methyl-N-({2-[(11aS)-5-(4-methylphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]phenyl}carbonyl)-L-cysteine
Catalog ID
STL531987
SMILES CSC[C@@H](C(=O)O)NC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1ccc(cc1)C)c1c(C2)c2ccccc2[nH]1
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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 C31H28N4O5S MW 568.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O5S/c1-17-11-13-18(14-12-17)27-26-21(19-7-3-5-9-22(19)32-26)15-25-29(37)35(31(40)34(25)27)24-10-6-4-8-20(24)28(36)33-23(16-41-2)30(38)39/h3-14,23,25,27,32H,15-16H2,1-2H3,(H,33,36)(H,38,39)/t23-,25-,27?/m0/s1InChIKey
GPEQRJREUHYPPF-HUSGHDHESA-NSynonyms
957024-66-7(2~(R))2((2((15~(S))10(4methylphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzoyl)amino)3methylsulfanylpropanoicacid
(2R)2(2((11aS)13dioxo5(ptolyl)1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamido)3(methylthio)propanoicacid
16405552
957024667
CSC(C@@H)(C(=O)O)NC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1ccc(cc1)C)c1c(C2)c2ccccc2(nH)1
InChI=1SC31H28N4O5Sc117111318(141217)272621(19735922(19)3226)152529(37)35(31(40)34(25)27)241064820(24)28(36)3323(16412)30(38)39h31423252732H1516H212H3(H3336)(H3839)t232527?m0s1
SmethylN((2((11aS)5(4methylphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)phenyl)carbonyl)Lcysteine
ZINC000070704924
ZINC000070704927
Check stock
See real-time availability and sample size for STL531987 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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