Vitas-M small molecule compound

(5E)-1-(2,5-dimethoxyphenyl)-5-{[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione

Catalog ID
STK561443
SMILES COc1ccc(c(c1)N1C(=NC(=O)/C(=C\Nc2c(=O)n(n(c2C)C)c2ccccc2)/C1=O)S)OC

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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 C24H23N5O5S MW 493.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O5S/c1-14-20(23(32)29(27(14)2)15-8-6-5-7-9-15)25-13-17-21(30)26-24(35)28(22(17)31)18-12-16(33-3)10-11-19(18)34-4/h5-13,25H,1-4H3,(H,26,30,35)/b17-13+
InChIKey
YMOBNKQXTQKQFD-GHRIWEEISA-N
Synonyms

(5E)1(25DIMETHOXYPHENYL)5(((15DIMETHYL3OXIDANYLIDENE2PHENYLPYRAZOL4YL)AMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(25dimethoxyphenyl)5(((15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5E)1(25DIMETHOXYPHENYL)5(((15DIMETHYL3OXO2PHENYL4PYRAZOLYL)AMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(25DIMETHOXYPHENYL)5(((15DIMETHYL3OXO2PHENYLPYRAZOL4YL)AMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(25DIMETHOXYPHENYL)5(((3KETO15DIMETHYL2PHENYL3PYRAZOLIN4YL)AMINO)METHYLENE)2THIOXOHEXAHYDROPYRIMIDINE46QUINONE
1(25DIMETHOXYPHENYL)5(1(15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YLAMINO)METH(E)YLIDENE)2THIOXODIHYDROPYRIMIDINE46DIONE
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC=C3C(=O)NC(=S)N(C3=O)C4=C(C=CC(=C4)OC)OC
COc1ccc(c(c1)N1C(=NC(=O)C(=CNc2c(=O)n(n(c2C)C)c2ccccc2)C1=O)S)OC
InChI=1SC24H23N5O5Sc11420(23(32)29(27(14)2)158657915)25131721(30)2624(35)28(22(17)31)181216(333)101119(18)344h51325H14H3(H263035)b1713+
MFCD03808650
ZINC000100587508
ZINC000102503949
ZINC100587508
ZINC17146542

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Available files

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