Vitas-M small molecule compound
2-[(Z)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl 4-methylbenzenesulfonate
Catalog ID
STK140457
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1/C=C\1/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 C24H20N2O4S MW 432.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O4S/c1-17-12-14-21(15-13-17)31(28,29)30-23-11-7-6-8-19(23)16-22-18(2)25-26(24(22)27)20-9-4-3-5-10-20/h3-16H,1-2H3/b22-16-InChIKey
ZXICIMVIHFDEKO-JWGURIENSA-NSynonyms
(2((Z)(3METHYL5OXO1PHENYLPYRAZOL4YLIDENE)METHYL)PHENYL)4METHYLBENZENESULFONATE
2((Z)(3METHYL5OXO1PHENYL15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)PHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C
Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1C=C1C(=NN(C1=O)c1ccccc1)C
InChI=1SC24H20N2O4Sc117121421(151317)31(2829)30231176819(23)162218(2)2526(24(22)27)2094351020h316H12H3b2216
MFCD00494078
ZINC000013016216
ZINC13016216
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