Vitas-M small molecule compound
5-(1,3-benzodioxol-5-yl)-3-(4-methylphenyl)-1-(methylsulfonyl)-4,5-dihydro-1H-pyrazole
Catalog ID
STL357224
SMILES Cc1ccc(cc1)C1=NN(C(C1)c1ccc2c(c1)OCO2)S(=O)(=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 C18H18N2O4S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O4S/c1-12-3-5-13(6-4-12)15-10-16(20(19-15)25(2,21)22)14-7-8-17-18(9-14)24-11-23-17/h3-9,16H,10-11H2,1-2H3InChIKey
NCISHZUBYKBAOU-UHFFFAOYSA-NSynonyms
836652-37-03(13BENZODIOXOL5YL)5(4METHYLPHENYL)2METHYLSULFONYL34DIHYDROPYRAZOLE
5(13BENZODIOXOL5YL)1MESYL3(PTOLYL)2PYRAZOLINE
5(13benzodioxol5yl)3(4methylphenyl)1(methylsulfonyl)45dihydro1Hpyrazole
5(benzo(d)(13)dioxol5yl)1(methylsulfonyl)3(ptolyl)45dihydro1Hpyrazole
5BENZO(13)DIOXOL5YL1METHANESULFONYL3PTOLYL45DIHYDRO1HPYRAZOLE
836652370
CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC4=C(C=C3)OCO4)S(=O)(=O)C
InChI=1SC18H18N2O4Sc1123513(6412)151016(20(1915)25(221)22)14781718(914)24112317h3916H1011H212H3
MFCD03692512
ZINC000005068614
ZINC000005068615
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