Vitas-M small molecule compound
N-({2-[(11aS)-5-(4-methoxyphenyl)-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
STL533186
SMILES COc1ccc(cc1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)N[C@H](C(=O)O)CS
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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 C30H26N4O6S MW 570.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N4O6S/c1-40-17-12-10-16(11-13-17)26-25-20(18-6-2-4-8-21(18)31-25)14-24-28(36)34(30(39)33(24)26)23-9-5-3-7-19(23)27(35)32-22(15-41)29(37)38/h2-13,22,24,26,31,41H,14-15H2,1H3,(H,32,35)(H,37,38)/t22-,24-,26?/m0/s1InChIKey
WROIYSXCBAJVDZ-RLANRKKRSA-NSynonyms
956965-44-9(2~(R))2((2((15~(S))10(4methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzoyl)amino)3sulfanylpropanoicacid
(2R)3mercapto2(2((11aS)5(4methoxyphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamido)propanoicacid
16405972
956965449
COc1ccc(cc1)C1N2(C@@H)(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)N(C@H)(C(=O)O)CS
InChI=1SC30H26N4O6Sc14017121016(111317)262520(18624821(18)3125)142428(36)34(30(39)33(24)26)23953719(23)27(35)3222(1541)29(37)38h2132224263141H1415H21H3(H3235)(H3738)t222426?m0s1
N((2((11aS)5(4methoxyphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)phenyl)carbonyl)Lcysteine
ZINC000070706410
ZINC000070706413
Check stock
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Check stock on Vitas-MAvailable files
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