Vitas-M small molecule compound
2-{[(E)-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK027082
SMILES NC(=O)c1c(/N=C/c2c(C)nn(c2Cl)c2ccccc2)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 C20H19ClN4OS MW 398.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4OS/c1-12-15(18(21)25(24-12)13-7-3-2-4-8-13)11-23-20-17(19(22)26)14-9-5-6-10-16(14)27-20/h2-4,7-8,11H,5-6,9-10H2,1H3,(H2,22,26)/b23-11+InChIKey
GRYLICRFCLNNEF-FOKLQQMPSA-NSynonyms
2(((E)(5chloro3methyl1phenyl1Hpyrazol4yl)methylidene)amino)4567tetrahydro1benzothiophene3carboxamide
2((E)(5chloro3methyl1phenylpyrazol4yl)methylideneamino)4567tetrahydro1benzothiophene3carboxamide
CC1=NN(C(=C1C=NC2=C(C3=C(S2)CCCC3)C(=O)N)Cl)C4=CC=CC=C4
InChI=1SC20H19ClN4OSc11215(18(21)25(2412)137324813)11232017(19(22)26)149561016(14)2720h247811H56910H21H3(H22226)b2311+
MFCD08050115
NC(=O)c1c(N=Cc2c(C)nn(c2Cl)c2ccccc2)sc2c1CCCC2
STK027082
ZINC000004593065
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