Vitas-M small molecule compound

1-[5-(cyclohex-1-en-1-ylmethyl)-1,3,4-thiadiazol-2-yl]-3-(4-fluorophenyl)urea

Catalog ID
STK038472
SMILES O=C(Nc1nnc(s1)CC1=CCCCC1)Nc1ccc(cc1)F

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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 C16H17FN4OS MW 332.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17FN4OS/c17-12-6-8-13(9-7-12)18-15(22)19-16-21-20-14(23-16)10-11-4-2-1-3-5-11/h4,6-9H,1-3,5,10H2,(H2,18,19,21,22)
InChIKey
YIFMHYHMVLMBEE-UHFFFAOYSA-N
Synonyms
426242-44-6
1(5(CYCLOHEX1EN1YLMETHYL)134THIADIAZOL2YL)3(4FLUOROPHENYL)UREA
1(5(CYCLOHEXEN1YLMETHYL)134THIADIAZOL2YL)3(4FLUOROPHENYL)UREA
426242446
C1CCC(=CC1)CC2=NN=C(S2)NC(=O)NC3=CC=C(C=C3)F
InChI=1SC16H17FN4OSc17126813(9712)1815(22)1916212014(2316)10114213511h469H13510H2(H218192122)
MFCD02639119
O=C(Nc1nnc(s1)CC1=CCCCC1)Nc1ccc(cc1)F
STK038472
ZINC000009170730
ZINC09170730
ZINC9170730

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Available files

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