methyl 2-{[(4-bromo-1-methyl-1H-pyrazol-5-yl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

SpectraBase Compound ID	2M9l9pOCiV8
InChI	InChI=1S/C16H18BrN3O3S/c1-8-4-5-9-11(6-8)24-15(12(9)16(22)23-3)19-14(21)13-10(17)7-18-20(13)2/h7-8H,4-6H2,1-3H3,(H,19,21)
InChIKey	NUHOYXRVCYPGPP-UHFFFAOYSA-N Google Search
Mol Weight	412.3 g/mol
Molecular Formula	C16H18BrN3O3S
Exact Mass	411.025226 g/mol

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SpectraBase Spectrum ID	AdICy8krwhF
Name	2-[(4-bromo-2-methyl-pyrazole-3-carbonyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H18BrN3O3S
InChI	InChI=1S/C16H18BrN3O3S/c1-8-4-5-9-11(6-8)24-15(12(9)16(22)23-3)19-14(21)13-10(17)7-18-20(13)2/h7-8H,4-6H2,1-3H3,(H,19,21)
InChIKey	NUHOYXRVCYPGPP-UHFFFAOYSA-N
Molecular Weight	412.302 g/mol
SMILES	N(C(c1[n](ncc1Br)C)=O)c1c(c2CCC(Cc2s1)C)C(=O)OC
SPLASH	splash10-03dr-3924700000-362e5bc1cc32b7ef0be8
Synonyms	2-[[(4-bromo-2-methyl-3-pyrazolyl)-oxomethyl]amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester Methyl 2-[(4-bromanyl-2-methyl-pyrazol-3-yl)carbonylamino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Methyl 2-[(4-bromo-2-methyl-pyrazole-3-carbonyl)amino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Methyl 2-[(4-bromo-2-methylpyrazole-3-carbonyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Wiley ID	1439081