Vitas-M small molecule compound

5-{[(2-methyl-4-nitrophenyl)amino]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione

Catalog ID
STK878359
SMILES S=C1NC(=O)C(=CNc2ccc(cc2C)[N+](=O)[O-])C(=O)N1

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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 C12H10N4O4S MW 306.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N4O4S/c1-6-4-7(16(19)20)2-3-9(6)13-5-8-10(17)14-12(21)15-11(8)18/h2-5,13H,1H3,(H2,14,15,17,18,21)
InChIKey
GSWIVUQFJFXKPO-UHFFFAOYSA-N
Synonyms
392315-95-6
392315956
5(((2METHYL4NITROPHENYL)AMINO)METHYLENE)2THIOXO13DIHYDROPYRIMIDINE46DIONE
5(((2METHYL4NITROPHENYL)AMINO)METHYLENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5(((2methyl4nitrophenyl)amino)methylidene)2thioxodihydropyrimidine46(1H5H)dione
5((2METHYL4NITROANILINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
CC1=C(C=CC(=C1)(N+)(=O)(O))NC=C2C(=O)NC(=S)NC2=O
InChI=1SC12H10N4O4Sc1647(16(19)20)239(6)135810(17)1412(21)1511(8)18h2513H1H3(H21415171821)
MFCD00697113
S=C1NC(=O)C(=CNc2ccc(cc2C)(N+)(=O)(O))C(=O)N1
ZINC000005277064
ZINC05277064
ZINC5277064

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Available files

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