Vitas-M small molecule compound
(4E)-2-(4-bromophenyl)-5-methyl-4-{[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295597
SMILES Brc1ccc(cc1)N1N=C(/C(=C\Nc2nc3c(s2)cc(cc3)C)/C1=O)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 C19H15BrN4OS MW 427.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15BrN4OS/c1-11-3-8-16-17(9-11)26-19(22-16)21-10-15-12(2)23-24(18(15)25)14-6-4-13(20)5-7-14/h3-10H,1-2H3,(H,21,22)/b15-10+InChIKey
RVZQWKOYOMOKKZ-XNTDXEJSSA-NSynonyms
(4E)2(4bromophenyl)5methyl4(((6methyl13benzothiazol2yl)amino)methylidene)24dihydro3Hpyrazol3one
(4E)2(4bromophenyl)5methyl4(((6methyl13benzothiazol2yl)amino)methylidene)pyrazol3one
Brc1ccc(cc1)N1N=C(C(=CNc2nc3c(s2)cc(cc3)C)C1=O)C
CC1=CC2=C(C=C1)N=C(S2)NC=C3C(=NN(C3=O)C4=CC=C(C=C4)Br)C
InChI=1SC19H15BrN4OSc111381617(911)2619(2216)21101512(2)2324(18(15)25)146413(20)5714h310H12H3(H2122)b1510+
MFCD28033042
ZINC000101077972
ZINC101077972
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