Vitas-M small molecule compound
(3Z)-6-(4-bromophenyl)-5-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-(methoxyimino)-1-methyl-1,5-dihydroimidazo[1,2-a]pyrrolo[3,2-d]imidazol-2(3H)-one
Catalog ID
STL447277
SMILES CO/N=c/1\c(=O)n(c2c1nc1n2cc(n1c1c(C)n(n(c1=O)c1ccccc1)C)c1ccc(cc1)Br)C
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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 C26H22BrN7O3 MW 560.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22BrN7O3/c1-15-22(25(36)34(31(15)3)18-8-6-5-7-9-18)33-19(16-10-12-17(27)13-11-16)14-32-23-20(28-26(32)33)21(29-37-4)24(35)30(23)2/h5-14H,1-4H3/b29-21-InChIKey
IBMVOHZCXCMLNX-ANYBSYGZSA-NSynonyms
(3Z)6(4bromophenyl)5(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)3(methoxyimino)1methyl15dihydroimidazo(12a)pyrrolo(32d)imidazol2(3H)one
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N3C(=CN4C3=NC5=C4N(C(=O)C5=NOC)C)C6=CC=C(C=C6)Br
CON=c1c(=O)n(c2c1nc1n2cc(n1c1c(C)n(n(c1=O)c1ccccc1)C)c1ccc(cc1)Br)C
InChI=1SC26H22BrN7O3c11522(25(36)34(31(15)3)188657918)3319(16101217(27)131116)14322320(2826(32)33)21(29374)24(35)30(23)2h514H14H3b2921
MFCD06240263
ZINC000008466674
ZINC101385258
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