Vitas-M small molecule compound

2-{[6-(4-cyclohexylphenyl)pyridazin-3-yl]sulfanyl}-1-(2,4,5-trimethylphenyl)ethanone

Catalog ID
STL074218
SMILES O=C(c1cc(C)c(cc1C)C)CSc1ccc(nn1)c1ccc(cc1)C1CCCCC1

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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 C27H30N2OS MW 430.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N2OS/c1-18-15-20(3)24(16-19(18)2)26(30)17-31-27-14-13-25(28-29-27)23-11-9-22(10-12-23)21-7-5-4-6-8-21/h9-16,21H,4-8,17H2,1-3H3
InChIKey
QPJFKHMWUUSRDN-UHFFFAOYSA-N
Synonyms

2((6(4cyclohexylphenyl)pyridazin3yl)sulfanyl)1(245trimethylphenyl)ethanone
2(6(4cyclohexylphenyl)pyridazin3yl)sulfanyl1(245trimethylphenyl)ethanone
CC1=CC(=C(C=C1C(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)C4CCCCC4)C)C
InChI=1SC27H30N2OSc1181520(3)24(1619(18)2)26(30)173127141325(282927)2311922(101223)217546821h91621H4817H213H3
MFCD18195612
ZINC000057486341
ZINC57486341

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Available files

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