Vitas-M small molecule compound

methyl 2-[({2-[(5-ethylthiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]-5-methyl-4-phenylthiophene-3-carboxylate

Catalog ID
STK436083
SMILES COC(=O)c1c(NC(=S)NNC(=O)c2csc(c2)CC)sc(c1c1ccccc1)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 C21H21N3O3S3 MW 459.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S3/c1-4-15-10-14(11-29-15)18(25)23-24-21(28)22-19-17(20(26)27-3)16(12(2)30-19)13-8-6-5-7-9-13/h5-11H,4H2,1-3H3,(H,23,25)(H2,22,24,28)
InChIKey
CFRVOZCMLXYVPD-UHFFFAOYSA-N
Synonyms

CCC1=CC(=CS1)C(=O)NNC(=S)NC2=C(C(=C(S2)C)C3=CC=CC=C3)C(=O)OC
InChI=1SC21H21N3O3S3c14151014(112915)18(25)232421(28)221917(20(26)273)16(12(2)3019)138657913h511H4H213H3(H2325)(H2222428)
METHYL2(((((5ETHYL(3THIENYL))CARBONYLAMINO)AMINO)THIOXOMETHYL)AMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
methyl2(((2((5ethylthiophen3yl)carbonyl)hydrazinyl)carbonothioyl)amino)5methyl4phenylthiophene3carboxylate
METHYL2(((5ETHYLTHIOPHENE3CARBONYL)AMINO)CARBAMOTHIOYLAMINO)5METHYL4PHENYLTHIOPHENE3CARBOXYLATE
MFCD03944455
ZINC000020191868
ZINC20191868

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Available files

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