Vitas-M small molecule compound

1,3-dimethyl-2-thioxo-5-[(1,2,5-triphenyl-1H-pyrrol-3-yl)methylidene]dihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK188175
SMILES CN1C(=S)N(C)C(=O)C(=Cc2cc(n(c2c2ccccc2)c2ccccc2)c2ccccc2)C1=O

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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 C29H23N3O2S MW 477.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N3O2S/c1-30-27(33)24(28(34)31(2)29(30)35)18-22-19-25(20-12-6-3-7-13-20)32(23-16-10-5-11-17-23)26(22)21-14-8-4-9-15-21/h3-19H,1-2H3
InChIKey
MGHLYNGGOIAWKG-UHFFFAOYSA-N
Synonyms

13DIMETHYL2SULFANYLIDENE5((125TRIPHENYLPYRROL3YL)METHYLIDENE)13DIAZINANE46DIONE
13DIMETHYL2THIOXO5((125TRIPHENYL1HPYRROL3YL)METHYLENE)DIHYDROPYRIMIDINE46(1H5H)DIONE
13DIMETHYL2THIOXO5((125TRIPHENYL1HPYRROL3YL)METHYLIDENE)DIHYDROPYRIMIDINE46(1H5H)DIONE
13DIMETHYL2THIOXO5((125TRIPHENYLPYRROL3YL)METHYLENE)13DIHYDROPYRIMIDINE46DIONE
CN1C(=O)C(=CC2=C(N(C(=C2)C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5)C(=O)N(C1=S)C
InChI=1SC29H23N3O2Sc13027(33)24(28(34)31(2)29(30)35)18221925(20126371320)32(2316105111723)26(22)21148491521h319H12H3
MFCD02779313
ZINC000003771403
ZINC03771403
ZINC3771403

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Available files

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