Vitas-M small molecule compound

ethyl 4-{[({5-[(3-phenylpropanoyl)amino]-1,3,4-thiadiazol-2-yl}sulfanyl)acetyl]amino}benzoate

Catalog ID
STK115311
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(s1)NC(=O)CCc1ccccc1

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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 C22H22N4O4S2 MW 470.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O4S2/c1-2-30-20(29)16-9-11-17(12-10-16)23-19(28)14-31-22-26-25-21(32-22)24-18(27)13-8-15-6-4-3-5-7-15/h3-7,9-12H,2,8,13-14H2,1H3,(H,23,28)(H,24,25,27)
InChIKey
ZLVVKSHUMBXADC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)CCC3=CC=CC=C3
ETHYL4((((5((3PHENYLPROPANOYL)AMINO)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((5(3PHENYLPROPANOYLAMINO)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC22H22N4O4S2c123020(29)1691117(121016)2319(28)143122262521(3222)2418(27)138156435715h37912H281314H21H3(H2328)(H242527)
MFCD03870190
ZINC000008794372
ZINC08794372
ZINC8794372

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Available files

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