Vitas-M small molecule compound
(4E)-2-(4-chlorophenyl)-5-methyl-4-{[(5-propyl-1,3,4-thiadiazol-2-yl)amino]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL295072
SMILES CCCc1nnc(s1)N/C=C/1\C(=NN(C1=O)c1ccc(cc1)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 C16H16ClN5OS MW 361.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN5OS/c1-3-4-14-19-20-16(24-14)18-9-13-10(2)21-22(15(13)23)12-7-5-11(17)6-8-12/h5-9H,3-4H2,1-2H3,(H,18,20)/b13-9+InChIKey
YVYJROWMGFFOHT-UKTHLTGXSA-NSynonyms
(4E)2(4chlorophenyl)5methyl4(((5propyl134thiadiazol2yl)amino)methylidene)24dihydro3Hpyrazol3one
(4E)2(4chlorophenyl)5methyl4(((5propyl134thiadiazol2yl)amino)methylidene)pyrazol3one
CCCC1=NN=C(S1)NC=C2C(=NN(C2=O)C3=CC=C(C=C3)Cl)C
CCCc1nnc(s1)NC=C1C(=NN(C1=O)c1ccc(cc1)Cl)C
InChI=1SC16H16ClN5OSc13414192016(2414)1891310(2)2122(15(13)23)127511(17)6812h59H34H212H3(H1820)b139+
MFCD28032878
ZINC000101141910
ZINC101141910
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