Vitas-M small molecule compound
N-(11-hydroxy-5-oxo-2,3,5,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-7-yl)-3-methyl-4-(1H-pyrrol-1-yl)benzamide
Catalog ID
STL314991
SMILES O=C(c1ccc(c(c1)C)n1cccc1)Nc1ccc2c(c1)C(=O)N1CCCC1C(=N2)O
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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 C24H22N4O3 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3/c1-15-13-16(6-9-20(15)27-10-2-3-11-27)22(29)25-17-7-8-19-18(14-17)24(31)28-12-4-5-21(28)23(30)26-19/h2-3,6-11,13-14,21H,4-5,12H2,1H3,(H,25,29)(H,26,30)InChIKey
XNSPBOCRZLWKIW-UHFFFAOYSA-NSynonyms
1435900-27-81435900278
CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)NC(=O)C4CCCN4C3=O)N5C=CC=C5
InChI=1SC24H22N4O3c1151316(6920(15)2710231127)22(29)2517781918(1417)24(31)28124521(28)23(30)2619h23611131421H4512H21H3(H2529)(H2630)
MFCD28026999
N(11hydroxy5oxo23511atetrahydro1Hpyrrolo(21c)(14)benzodiazepin7yl)3methyl4(1Hpyrrol1yl)benzamide
N(611dioxo6a789tetrahydro5Hpyrrolo(21c)(14)benzodiazepin2yl)3methyl4pyrrol1ylbenzamide
ZINC000095476740
ZINC000095476741
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