Vitas-M small molecule compound
ethyl 5-({[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]acetyl}amino)-1-phenyl-1H-pyrazole-4-carboxylate
Catalog ID
STK762529
SMILES CCOc1ccc2c(c1)sc(n2)SCC(=O)Nc1c(cnn1c1ccccc1)C(=O)OCC
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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 C23H22N4O4S2 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4S2/c1-3-30-16-10-11-18-19(12-16)33-23(25-18)32-14-20(28)26-21-17(22(29)31-4-2)13-24-27(21)15-8-6-5-7-9-15/h5-13H,3-4,14H2,1-2H3,(H,26,28)InChIKey
RPPGXEPMRRYJIH-UHFFFAOYSA-NSynonyms
CCOC1=CC2=C(C=C1)N=C(S2)SCC(=O)NC3=C(C=NN3C4=CC=CC=C4)C(=O)OCC
ethyl5((((6ethoxy13benzothiazol2yl)sulfanyl)acetyl)amino)1phenyl1Hpyrazole4carboxylate
ETHYL5((2((6ETHOXY13BENZOTHIAZOL2YL)SULFANYL)ACETYL)AMINO)1PHENYLPYRAZOLE4CARBOXYLATE
InChI=1SC23H22N4O4S2c13301610111819(1216)3323(2518)321420(28)262117(22(29)3142)132427(21)158657915h513H3414H212H3(H2628)
MFCD01872064
ZINC000000709397
ZINC00709397
ZINC709397
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