Vitas-M small molecule compound

6-chloro-N-{2-oxo-2-[(1R,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}-1,3,4,9-tetrahydro-2H-beta-carboline-2-carboxamide

Catalog ID
STL535620
SMILES Clc1ccc2c(c1)c1CCN(Cc1[nH]2)C(=O)NCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

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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 C25H26ClN5O3 MW 479.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN5O3/c26-17-4-5-20-19(9-17)18-6-7-29(14-21(18)28-20)25(34)27-10-24(33)30-11-15-8-16(13-30)22-2-1-3-23(32)31(22)12-15/h1-5,9,15-16,28H,6-8,10-14H2,(H,27,34)/t15-,16+/m0/s1
InChIKey
PIOMJMDKICJAOI-JKSUJKDBSA-N
Synonyms
1175751-32-2
1175751322
42506702
6chloro~(N)(2oxo2((1~(R)9~(S))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)ethyl)1349tetrahydropyrido(34b)indole2carboxamide
6chloroN(2oxo2((1R5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)ethyl)1349tetrahydro2Hbetacarboline2carboxamide
6chloroN(2oxo2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)ethyl)34dihydro1Hpyrido(34b)indole2(9H)carboxamide
Clc1ccc2c(c1)c1CCN(Cc1(nH)2)C(=O)NCC(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC25H26ClN5O3c2617452019(917)186729(1421(18)2820)25(34)271024(33)301115816(1330)2221323(32)31(22)1215h159151628H681014H2(H2734)t1516+m0s1
MFCD12028878
ZINC000012296451
ZINC12296451

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Available files

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