Vitas-M small molecule compound

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

Catalog ID
STL530035
SMILES O=C(c1ccccc1N1C(=O)[C@H]2N(C1=O)C(c1ccccc1)c1c(C2)c2ccccc2[nH]1)NCC1CCCO1

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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 C31H28N4O4 MW 520.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N4O4/c36-29(32-18-20-11-8-16-39-20)22-13-5-7-15-25(22)35-30(37)26-17-23-21-12-4-6-14-24(21)33-27(23)28(34(26)31(35)38)19-9-2-1-3-10-19/h1-7,9-10,12-15,20,26,28,33H,8,11,16-18H2,(H,32,36)/t20?,26-,28?/m0/s1
InChIKey
KNFHTQBFBWLJMB-DAHSEUATSA-N
Synonyms
956998-94-0
16403854
2((11aS)13dioxo5phenyl1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)N((tetrahydrofuran2yl)methyl)benzamide
2((11aS)13dioxo5phenyl561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)N(tetrahydrofuran2ylmethyl)benzamide
2((15~(S))1214dioxo10phenyl81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)~(N)(oxolan2ylmethyl)benzamide
956998940
InChI=1SC31H28N4O4c3629(321820118163920)2213571525(22)3530(37)2617232112461424(21)3327(23)28(34(26)31(35)38)1992131019h17910121520262833H8111618H2(H3236)t20?2628?m0s1
MFCD06765442
O=C(c1ccccc1N1C(=O)(C@H)2N(C1=O)C(c1ccccc1)c1c(C2)c2ccccc2(nH)1)NCC1CCCO1
ZINC000008790127
ZINC000012881832

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Available files

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