Vitas-M small molecule compound
N-butyl-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]benzamide
Catalog ID
STL529891
SMILES CCCCNC(=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 C31H30N4O3 MW 506.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O3/c1-3-4-17-32-29(36)22-10-6-8-12-25(22)35-30(37)26-18-23-21-9-5-7-11-24(21)33-27(23)28(34(26)31(35)38)20-15-13-19(2)14-16-20/h5-16,26,28,33H,3-4,17-18H2,1-2H3,(H,32,36)/t26-,28?/m0/s1InChIKey
AIMKIBSUCXZVAY-QODXOHEASA-NSynonyms
956998-85-9~(N)butyl2((15~(S))10(4methylphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16403834
956998859
CCCCNC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1ccc(cc1)C)c1c(C2)c2ccccc2(nH)1
InChI=1SC31H30N4O3c134173229(36)2210681225(22)3530(37)261823219571124(21)3327(23)28(34(26)31(35)38)20151319(2)141620h516262833H341718H212H3(H3236)t2628?m0s1
MFCD06765387
Nbutyl2((11aS)13dioxo5(ptolyl)1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
Nbutyl2((11aS)5(4methylphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
ZINC000012881744
ZINC000012881748
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