Vitas-M small molecule compound

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

Catalog ID
STK090297
SMILES O=C(Nc1ccc(cc1)C)Nc1nnc(s1)CSCc1cccc(c1)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 C19H20N4OS2 MW 384.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4OS2/c1-13-6-8-16(9-7-13)20-18(24)21-19-23-22-17(26-19)12-25-11-15-5-3-4-14(2)10-15/h3-10H,11-12H2,1-2H3,(H2,20,21,23,24)
InChIKey
YKXCJKDMFLDNIZ-UHFFFAOYSA-N
Synonyms
426242-30-0
1(4METHYLPHENYL)3(5((((3METHYLPHENYL)METHYL)SULFANYL)METHYL)134THIADIAZOL2YL)UREA
1(4METHYLPHENYL)3(5((3METHYLPHENYL)METHYLSULFANYLMETHYL)134THIADIAZOL2YL)UREA
1(5(((3METHYLBENZYL)SULFANYL)METHYL)134THIADIAZOL2YL)3(4METHYLPHENYL)UREA
1(5(((3methylbenzyl)thio)methyl)134thiadiazol2yl)3(ptolyl)urea
426242300
CC1=CC=C(C=C1)NC(=O)NC2=NN=C(S2)CSCC3=CC=CC(=C3)C
InChI=1SC19H20N4OS2c1136816(9713)2018(24)2119232217(2619)1225111553414(2)1015h310H1112H212H3(H220212324)
MFCD02639115
O=C(Nc1ccc(cc1)C)Nc1nnc(s1)CSCc1cccc(c1)C
STK090297
ZINC000017044531
ZINC17044531

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Available files

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