Vitas-M small molecule compound
methyl 2-{[(2-{[(2-chloro-4-fluorobenzyl)sulfanyl]acetyl}hydrazinyl)carbonothioyl]amino}-4-ethyl-5-methylthiophene-3-carboxylate
Catalog ID
STK445704
SMILES COC(=O)c1c(NC(=S)NNC(=O)CSCc2ccc(cc2Cl)F)sc(c1CC)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 C19H21ClFN3O3S3 MW 490.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21ClFN3O3S3/c1-4-13-10(2)30-17(16(13)18(26)27-3)22-19(28)24-23-15(25)9-29-8-11-5-6-12(21)7-14(11)20/h5-7H,4,8-9H2,1-3H3,(H,23,25)(H2,22,24,28)InChIKey
FECWDCINIMONFG-UHFFFAOYSA-NSynonyms
CCC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)CSCC2=C(C=C(C=C2)F)Cl)C
InChI=1SC19H21ClFN3O3S3c141310(2)3017(16(13)18(26)273)2219(28)242315(25)9298115612(21)714(11)20h57H489H213H3(H2325)(H2222428)
METHYL2((((2((2CHLORO4FLUOROPHENYL)METHYLTHIO)ACETYLAMINO)AMINO)THIOXOMETHYL)AMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
methyl2(((2(((2chloro4fluorobenzyl)sulfanyl)acetyl)hydrazinyl)carbonothioyl)amino)4ethyl5methylthiophene3carboxylate
methyl2(((2((2chloro4fluorophenyl)methylsulfanyl)acetyl)amino)carbamothioylamino)4ethyl5methylthiophene3carboxylate
MFCD04057597
ZINC000020191502
ZINC20191502
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