Vitas-M small molecule compound

methyl 4-({[(5-{[(2-chlorophenyl)carbonyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}amino)benzoate

Catalog ID
STK073903
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(s1)NC(=O)c1ccccc1Cl

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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 C19H15ClN4O4S2 MW 462.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN4O4S2/c1-28-17(27)11-6-8-12(9-7-11)21-15(25)10-29-19-24-23-18(30-19)22-16(26)13-4-2-3-5-14(13)20/h2-9H,10H2,1H3,(H,21,25)(H,22,23,26)
InChIKey
SMWAGCWGVYKPFR-UHFFFAOYSA-N
Synonyms
532433-84-4
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=CC=C3Cl
COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(s1)NC(=O)c1ccccc1Cl
InChI=1SC19H15ClN4O4S2c12817(27)116812(9711)2115(25)102919242318(3019)2216(26)13423514(13)20h29H10H21H3(H2125)(H222326)
METHYL4(((((5Z)5(((2CHLOROPHENYL)CARBONYL)IMINO)45DIHYDRO134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((((5(((2CHLOROPHENYL)CARBONYL)AMINO)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((((5((2CHLOROBENZOYL)AMINO)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2((5((2CHLOROBENZOYL)AMINO)134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl4(2((5(2chlorobenzamido)134thiadiazol2yl)thio)acetamido)benzoate
MFCD03356922
STK073903
ZINC000009012176
ZINC09012176
ZINC9012176

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.