Vitas-M small molecule compound

N-(3-{[3-(acetylamino)phenyl]amino}-3-oxopropyl)-6-chloro-1,3,4,9-tetrahydro-2H-beta-carboline-2-carboxamide

Catalog ID
STK642861
SMILES O=C(Nc1cccc(c1)NC(=O)C)CCNC(=O)N1CCc2c(C1)[nH]c1c2cc(cc1)Cl

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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 C23H24ClN5O3 MW 453.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClN5O3/c1-14(30)26-16-3-2-4-17(12-16)27-22(31)7-9-25-23(32)29-10-8-18-19-11-15(24)5-6-20(19)28-21(18)13-29/h2-6,11-12,28H,7-10,13H2,1H3,(H,25,32)(H,26,30)(H,27,31)
InChIKey
RQFWQWDLVBHVBF-UHFFFAOYSA-N
Synonyms
1081138-04-6
1081138046
CC(=O)NC1=CC(=CC=C1)NC(=O)CCNC(=O)N2CCC3=C(C2)NC4=C3C=C(C=C4)Cl
InChI=1SC23H24ClN5O3c114(30)261632417(1216)2722(31)792523(32)2910818191115(24)5620(19)2821(18)1329h26111228H71013H21H3(H2532)(H2630)(H2731)
MFCD12210632
N(3((3(acetylamino)phenyl)amino)3oxopropyl)6chloro1349tetrahydro2Hbetacarboline2carboxamide
N(3((3acetamidophenyl)amino)3oxopropyl)6chloro34dihydro1Hpyrido(34b)indole2(9H)carboxamide
N(3(3acetamidoanilino)3oxopropyl)6chloro1349tetrahydropyrido(34b)indole2carboxamide
O=C(Nc1cccc(c1)NC(=O)C)CCNC(=O)N1CCc2c(C1)(nH)c1c2cc(cc1)Cl
ZINC000020745971
ZINC20745971

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Available files

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