Vitas-M small molecule compound
(5Z)-5-(4-bromobenzylidene)-9-(4-bromophenyl)-4,5,6,7,8,9-hexahydro[1,2,4]triazolo[5,1-b]quinazoline
Catalog ID
STK993655
SMILES Brc1ccc(cc1)/C=C\1/CCCC2=C1Nc1ncnn1C2c1ccc(cc1)Br
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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 C22H18Br2N4 MW 498.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Br2N4/c23-17-8-4-14(5-9-17)12-16-2-1-3-19-20(16)27-22-25-13-26-28(22)21(19)15-6-10-18(24)11-7-15/h4-13,21H,1-3H2,(H,25,26,27)/b16-12-InChIKey
IDIPILJMXMOMNM-VBKFSLOCSA-NSynonyms
(5Z)5(4bromobenzylidene)9(4bromophenyl)456789hexahydro(124)triazolo(51b)quinazoline
(5Z)9(4bromophenyl)5((4bromophenyl)methylidene)6789tetrahydro1H(124)triazolo(51b)quinazoline
Brc1ccc(cc1)C=C1CCCC2=C1Nc1ncnn1C2c1ccc(cc1)Br
C1CC(=CC2=CC=C(C=C2)Br)C3=C(C1)C(N4C(=N3)N=CN4)C5=CC=C(C=C5)Br
InChI=1SC22H18Br2N4c23178414(5917)12162131920(16)272225132628(22)21(19)1561018(24)11715h41321H13H2(H252627)b1612
MFCD18184947
ZINC000038161439
ZINC000038161440
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