Vitas-M small molecule compound
N'-{(E)-[1-(3-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetohydrazide
Catalog ID
STL137426
SMILES O=C(CSc1nc(C)cc(n1)C)N/N=C/c1cc(n(c1C)c1cccc(c1)Cl)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 C21H22ClN5OS MW 427.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5OS/c1-13-8-14(2)25-21(24-13)29-12-20(28)26-23-11-17-9-15(3)27(16(17)4)19-7-5-6-18(22)10-19/h5-11H,12H2,1-4H3,(H,26,28)/b23-11+InChIKey
KKOGWWLSMHCVIJ-FOKLQQMPSA-NSynonyms
CC1=CC(=NC(=N1)SCC(=O)NN=CC2=C(N(C(=C2)C)C3=CC(=CC=C3)Cl)C)C
InChI=1SC21H22ClN5OSc113814(2)2521(2413)291220(28)26231117915(3)27(16(17)4)1975618(22)1019h511H12H214H3(H2628)b2311+
MFCD01967754
N((1(3CHLOROPHENYL)25DIMETHYL1HPYRROL3YL)METHYLENE)2((46DIMETHYL2PYRIMIDINYL)SULFANYL)ACETOHYDRAZIDE
N((E)(1(3chlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)2((46dimethylpyrimidin2yl)sulfanyl)acetohydrazide
N((E)(1(3CHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENEAMINO)2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETAMIDE
O=C(CSc1nc(C)cc(n1)C)NN=Cc1cc(n(c1C)c1cccc(c1)Cl)C
ZINC000000726190
ZINC33336452
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