Vitas-M small molecule compound

2-[(11aS)-5-(3-methoxyphenyl)-1,3-dioxo-5,6,11,11a-tetrahydro-1H-imidazo[1',5':1,6]pyrido[3,4-b]indol-2(3H)-yl]-N-(3-methoxypropyl)benzamide

Catalog ID
STL532668
SMILES COCCCNC(=O)c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1cccc(c1)OC)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 C31H30N4O5 MW 538.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O5/c1-39-16-8-15-32-29(36)22-12-4-6-14-25(22)35-30(37)26-18-23-21-11-3-5-13-24(21)33-27(23)28(34(26)31(35)38)19-9-7-10-20(17-19)40-2/h3-7,9-14,17,26,28,33H,8,15-16,18H2,1-2H3,(H,32,36)/t26-,28?/m0/s1
InChIKey
FYIFDUPGJJAEHD-QODXOHEASA-N
Synonyms
957030-23-8
16404591
2((11aS)5(3methoxyphenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)N(3methoxypropyl)benzamide
2((11aS)5(3methoxyphenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)N(3methoxypropyl)benzamide
2((15~(S))10(3methoxyphenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)~(N)(3methoxypropyl)benzamide
957030238
COCCCNC(=O)c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1cccc(c1)OC)c1c(C2)c2ccccc2(nH)1
InChI=1SC31H30N4O5c139168153229(36)2212461425(22)3530(37)2618232111351324(21)3327(23)28(34(26)31(35)38)19971020(1719)402h3791417262833H8151618H212H3(H3236)t2628?m0s1
MFCD06767547
ZINC000070700770
ZINC000070700772

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.