Vitas-M small molecule compound

2-[(11aS)-5-(3-chlorophenyl)-1,3-dioxo-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
STL529513
SMILES Clc1cccc(c1)C1N2[C@@H](Cc3c1[nH]c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)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 C31H27ClN4O4 MW 555.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27ClN4O4/c32-19-8-5-7-18(15-19)28-27-23(21-10-1-3-12-24(21)34-27)16-26-30(38)36(31(39)35(26)28)25-13-4-2-11-22(25)29(37)33-17-20-9-6-14-40-20/h1-5,7-8,10-13,15,20,26,28,34H,6,9,14,16-17H2,(H,33,37)/t20?,26-,28?/m0/s1
InChIKey
IMSSEQZNSUPGIE-DAHSEUATSA-N
Synonyms
957024-76-9
16405559
2((11aS)5(3chlorophenyl)13dioxo1111adihydro1Himidazo(1516)pyrido(34b)indol2(3H5H6H)yl)N((tetrahydrofuran2yl)methyl)benzamide
2((11aS)5(3chlorophenyl)13dioxo561111atetrahydro1Himidazo(1516)pyrido(34b)indol2(3H)yl)N(tetrahydrofuran2ylmethyl)benzamide
2((15~(S))10(3chlorophenyl)1214dioxo81113triazatetracyclo(7700^(27)0^(1115))hexadeca1(9)246tetraen13yl)~(N)(oxolan2ylmethyl)benzamide
957024769
Clc1cccc(c1)C1N2(C@@H)(Cc3c1(nH)c1c3cccc1)C(=O)N(C2=O)c1ccccc1C(=O)NCC1CCCO1
InChI=1SC31H27ClN4O4c321985718(1519)282723(2110131224(21)3427)162630(38)36(31(39)35(26)28)2513421122(25)29(37)33172096144020h157810131520262834H69141617H2(H3337)t20?2628?m0s1
ZINC000070704952
ZINC000070704963

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Available files

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