Vitas-M small molecule compound

1-(5-{[(2,4-dichlorobenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2-yl)-3-(3-methoxyphenyl)urea

Catalog ID
STK021258
SMILES COc1cccc(c1)NC(=O)Nc1nnc(s1)CSCc1ccc(cc1Cl)Cl

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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 C18H16Cl2N4O2S2 MW 455.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16Cl2N4O2S2/c1-26-14-4-2-3-13(8-14)21-17(25)22-18-24-23-16(28-18)10-27-9-11-5-6-12(19)7-15(11)20/h2-8H,9-10H2,1H3,(H2,21,22,24,25)
InChIKey
DGMYQWSOZBWWGL-UHFFFAOYSA-N
Synonyms
426239-87-4
1(5(((24DICHLOROBENZYL)SULFANYL)METHYL)134THIADIAZOL2YL)3(3METHOXYPHENYL)UREA
1(5(((24dichlorobenzyl)thio)methyl)134thiadiazol2yl)3(3methoxyphenyl)urea
1(5((24DICHLOROPHENYL)METHYLSULFANYLMETHYL)134THIADIAZOL2YL)3(3METHOXYPHENYL)UREA
426239874
COC1=CC=CC(=C1)NC(=O)NC2=NN=C(S2)CSCC3=C(C=C(C=C3)Cl)Cl
COc1cccc(c1)NC(=O)Nc1nnc(s1)CSCc1ccc(cc1Cl)Cl
InChI=1SC18H16Cl2N4O2S2c1261442313(814)2117(25)2218242316(2818)10279115612(19)715(11)20h28H910H21H3(H221222425)
MFCD02638641
STK021258
ZINC000008739864
ZINC08739864
ZINC8739864

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Available files

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