Vitas-M small molecule compound

2-(4-chlorophenyl)-3-(4-methoxyphenyl)tetrahydro-1H,5H-pyrazolo[1,2-a][1,2,4]triazole-1-thione

Catalog ID
STK710566
SMILES COc1ccc(cc1)C1N(c2ccc(cc2)Cl)C(=S)N2N1CCC2

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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 C18H18ClN3OS MW 359.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN3OS/c1-23-16-9-3-13(4-10-16)17-20-11-2-12-21(20)18(24)22(17)15-7-5-14(19)6-8-15/h3-10,17H,2,11-12H2,1H3
InChIKey
VWIOTOZJTBCDJI-UHFFFAOYSA-N
Synonyms
329350-90-5
(3R)2(4CHLOROPHENYL)3(4METHOXYPHENYL)TETRAHYDRO1H5HPYRAZOLO(12A)(124)TRIAZOLE1THIONE
2(4chlorophenyl)1(4methoxyphenyl)1567tetrahydropyrazolo(12a)(124)triazole3thione
2(4chlorophenyl)3(4methoxyphenyl)tetrahydro1H5Hpyrazolo(12a)(124)triazole1thione
2(4chlorophenyl)3(4methoxyphenyl)tetrahydropyrazolo(12a)(124)triazole1(5H)thione
329350905
COC1=CC=C(C=C1)C2N3CCCN3C(=S)N2C4=CC=C(C=C4)Cl
InChI=1SC18H18ClN3OSc123169313(41016)17201121221(20)18(24)22(17)157514(19)6815h31017H21112H21H3
MFCD03007864
ZINC000001137363
ZINC000001137364

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Available files

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