Vitas-M small molecule compound

methyl 3-chloro-6-({[(1-ethyl-1H-pyrazol-5-yl)methyl](methyl)carbamothioyl}amino)-1-benzothiophene-2-carboxylate

Catalog ID
STK443502
SMILES COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)N(Cc1ccnn1CC)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 C18H19ClN4O2S2 MW 422.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19ClN4O2S2/c1-4-23-12(7-8-20-23)10-22(2)18(26)21-11-5-6-13-14(9-11)27-16(15(13)19)17(24)25-3/h5-9H,4,10H2,1-3H3,(H,21,26)
InChIKey
SBITYVYGRLOYHI-UHFFFAOYSA-N
Synonyms

CCN1C(=CC=N1)CN(C)C(=S)NC2=CC3=C(C=C2)C(=C(S3)C(=O)OC)Cl
InChI=1SC18H19ClN4O2S2c142312(782023)1022(2)18(26)2111561314(911)2716(15(13)19)17(24)253h59H410H213H3(H2126)
METHYL3CHLORO6(((((1ETHYLPYRAZOL5YL)METHYL)METHYLAMINO)THIOXOMETHYL)AMINO)BENZO(B)THIOPHENE2CARBOXYLATE
methyl3chloro6((((1ethyl1Hpyrazol5yl)methyl)(methyl)carbamothioyl)amino)1benzothiophene2carboxylate
methyl3chloro6(((2ethylpyrazol3yl)methylmethylcarbamothioyl)amino)1benzothiophene2carboxylate
MFCD04054784
ZINC000017093416
ZINC17093416

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Available files

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