Vitas-M small molecule compound
methyl 6-{[(2-{[(2-bromobenzyl)sulfanyl]acetyl}hydrazinyl)carbonothioyl]amino}-3-chloro-1-benzothiophene-2-carboxylate
Catalog ID
STK458216
SMILES COC(=O)c1sc2c(c1Cl)ccc(c2)NC(=S)NNC(=O)CSCc1ccccc1Br
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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 C20H17BrClN3O3S3 MW 558.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17BrClN3O3S3/c1-28-19(27)18-17(22)13-7-6-12(8-15(13)31-18)23-20(29)25-24-16(26)10-30-9-11-4-2-3-5-14(11)21/h2-8H,9-10H2,1H3,(H,24,26)(H2,23,25,29)InChIKey
AEFLLJLPRKXKQP-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(C2=C(S1)C=C(C=C2)NC(=S)NNC(=O)CSCC3=CC=CC=C3Br)Cl
InChI=1SC20H17BrClN3O3S3c12819(27)1817(22)137612(815(13)3118)2320(29)252416(26)1030911423514(11)21h28H910H21H3(H2426)(H2232529)
METHYL6((((2((2BROMOPHENYL)METHYLTHIO)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)3CHLOROBENZO(B)THIOPHENE2CARBOXYLATE
methyl6(((2(((2bromobenzyl)sulfanyl)acetyl)hydrazinyl)carbonothioyl)amino)3chloro1benzothiophene2carboxylate
METHYL6(((2(((2BROMOBENZYL)SULFANYL)ACETYL)HYDRAZINYL)CARBOTHIOYL)AMINO)3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
METHYL6(((2((2BROMOPHENYL)METHYLSULFANYL)ACETYL)AMINO)CARBAMOTHIOYLAMINO)3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
MFCD04137414
ZINC000002852705
ZINC2852705
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