Vitas-M small molecule compound

1-(3-chlorophenyl)-3-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]urea

Catalog ID
STK385485
SMILES CC(Cc1nnc(s1)NC(=O)Nc1cccc(c1)Cl)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 C13H15ClN4OS MW 310.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClN4OS/c1-8(2)6-11-17-18-13(20-11)16-12(19)15-10-5-3-4-9(14)7-10/h3-5,7-8H,6H2,1-2H3,(H2,15,16,18,19)
InChIKey
ZRLBTUBTKWVWRG-UHFFFAOYSA-N
Synonyms

((3CHLOROPHENYL)AMINO)N(5(2METHYLPROPYL)(134THIADIAZOL2YL))CARBOXAMIDE
1(3CHLOROPHENYL)3((2Z)5(2METHYLPROPYL)134THIADIAZOL2(3H)YLIDENE)UREA
1(3CHLOROPHENYL)3(5(2METHYLPROPYL)134THIADIAZOL2YL)UREA
1(3chlorophenyl)3(5isobutyl134thiadiazol2yl)urea
CC(C)CC1=NN=C(S1)NC(=O)NC2=CC(=CC=C2)Cl
InChI=1SC13H15ClN4OSc18(2)611171813(2011)1612(19)15105349(14)710h3578H6H212H3(H215161819)
MFCD01364017
ZINC17045072

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Available files

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