Vitas-M small molecule compound
2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl 4-bromo-1-methyl-1H-pyrazole-3-carboxylate
Catalog ID
STK304855
SMILES N#Cc1c(NC(=O)COC(=O)c2nn(cc2Br)C)sc2c1CCCC2
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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 C16H15BrN4O3S MW 423.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN4O3S/c1-21-7-11(17)14(20-21)16(23)24-8-13(22)19-15-10(6-18)9-4-2-3-5-12(9)25-15/h7H,2-5,8H2,1H3,(H,19,22)InChIKey
FYYANOLXTWWUGI-UHFFFAOYSA-NSynonyms
1005620-21-2(2((3cyano4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)4bromo1methylpyrazole3carboxylate
1005620212
2((3cyano4567tetrahydro1benzothiophen2yl)amino)2oxoethyl4bromo1methyl1Hpyrazole3carboxylate
CN1C=C(C(=N1)C(=O)OCC(=O)NC2=C(C3=C(S2)CCCC3)C#N)Br
InChI=1SC16H15BrN4O3Sc121711(17)14(2021)16(23)24813(22)191510(618)9423512(9)2515h7H258H21H3(H1922)
MFCD04051368
ZINC000002782214
ZINC02782214
ZINC2782214
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