Vitas-M small molecule compound

N-butyl-4-[(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
STL533025
SMILES CCCCNC(=O)c1ccc(cc1)N1C(=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)21-13-15-22(16-14-21)34-30(37)26-18-24-23-7-5-6-8-25(23)33-27(24)28(35(26)31(34)38)20-11-9-19(2)10-12-20/h5-16,26,28,33H,3-4,17-18H2,1-2H3,(H,32,36)/t26-,28?/m0/s1
InChIKey
IHLQXFZTZGSHGP-QODXOHEASA-N
Synonyms
956954-04-4
~(N)butyl4((15~(S))10(4methylphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)benzamide
16404801
956954044
CCCCNC(=O)c1ccc(cc1)N1C(=O)(C@H)2N(C1=O)C(c1ccc(cc1)C)c1c(C2)c2ccccc2(nH)1
InChI=1SC31H30N4O3c134173229(36)21131522(161421)3430(37)26182423756825(23)3327(24)28(35(26)31(34)38)2011919(2)101220h516262833H341718H212H3(H3236)t2628?m0s1
MFCD06768128
Nbutyl4((11aS)13dioxo5(ptolyl)1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)benzamide
Nbutyl4((11aS)5(4methylphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)benzamide
ZINC000008790988
ZINC000008790989

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Available files

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