Vitas-M small molecule compound
4-(4-bromophenyl)-6,7-dimethyl-2-phenyl-2,4-dihydro-3H-1,2,4-triazepin-3-one
Catalog ID
STL271568
SMILES Brc1ccc(cc1)n1cc(C)c(nn(c1=O)c1ccccc1)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 C18H16BrN3O MW 370.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN3O/c1-13-12-21(16-10-8-15(19)9-11-16)18(23)22(20-14(13)2)17-6-4-3-5-7-17/h3-12H,1-2H3InChIKey
KRXVCCKXANBOCI-UHFFFAOYSA-NSynonyms
4(4bromophenyl)67dimethyl2phenyl124triazepin3one
4(4bromophenyl)67dimethyl2phenyl24dihydro3H124triazepin3one
CC1=CN(C(=O)N(N=C1C)C2=CC=CC=C2)C3=CC=C(C=C3)Br
InChI=1SC18H16BrN3Oc1131221(1610815(19)91116)18(23)22(2014(13)2)176435717h312H12H3
MFCD24853421
ZINC000028526905
ZINC28526905
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