Vitas-M small molecule compound

1-(2-{[3-chloro-4-(pentyloxy)benzyl]sulfanyl}ethyl)-3-phenylthiourea

Catalog ID
STK524791
SMILES CCCCCOc1ccc(cc1Cl)CSCCNC(=S)Nc1ccccc1

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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 C21H27ClN2OS2 MW 423.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27ClN2OS2/c1-2-3-7-13-25-20-11-10-17(15-19(20)22)16-27-14-12-23-21(26)24-18-8-5-4-6-9-18/h4-6,8-11,15H,2-3,7,12-14,16H2,1H3,(H2,23,24,26)
InChIKey
QAXMNBBLHDNFBB-UHFFFAOYSA-N
Synonyms
36757-76-3
1(2((3chloro4(pentyloxy)benzyl)sulfanyl)ethyl)3phenylthiourea
1(2((3chloro4(pentyloxy)benzyl)thio)ethyl)3phenylthiourea
1(2((3CHLORO4PENTOXYPHENYL)METHYLSULFANYL)ETHYL)3PHENYLTHIOUREA
36757763
CCCCCOC1=C(C=C(C=C1)CSCCNC(=S)NC2=CC=CC=C2)Cl
InChI=1SC21H27ClN2OS2c1237132520111017(1519(20)22)162714122321(26)24188546918h4681115H237121416H21H3(H2232426)
MFCD00778741
ZINC000004784789
ZINC04784789
ZINC4784789

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Available files

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