Vitas-M small molecule compound

1,3-diphenyl-5-[(1-propyl-1H-indol-3-yl)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK580016
SMILES CCCn1cc(c2c1cccc2)/C=C/1\C(=O)N(c2ccccc2)C(=S)N(C1=O)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 C28H23N3O2S MW 465.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O2S/c1-2-17-29-19-20(23-15-9-10-16-25(23)29)18-24-26(32)30(21-11-5-3-6-12-21)28(34)31(27(24)33)22-13-7-4-8-14-22/h3-16,18-19H,2,17H2,1H3
InChIKey
PEHPKPSUUNPYKY-UHFFFAOYSA-N
Synonyms
840496-39-1
13diphenyl5((1propyl1Hindol3yl)methylene)2thioxodihydropyrimidine46(1H5H)dione
13diphenyl5((1propyl1Hindol3yl)methylidene)2thioxodihydropyrimidine46(1H5H)dione
13DIPHENYL5((1PROPYLINDOL3YL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
840496391
CCCN1C=C(C2=CC=CC=C21)C=C3C(=O)N(C(=S)N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5
CCCn1cc(c2c1cccc2)C=C1C(=O)N(c2ccccc2)C(=S)N(C1=O)c1ccccc1
InChI=1SC28H23N3O2Sc1217291920(23159101625(23)29)182426(32)30(21115361221)28(34)31(27(24)33)22137481422h3161819H217H21H3
MFCD04008183
ZINC000009465917
ZINC09465917
ZINC9465917

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Available files

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