Vitas-M small molecule compound

propan-2-yl 4-(3,4-dichlorophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK797467
SMILES CC(OC(=O)C1=C(C)NC(=S)NC1c1ccc(c(c1)Cl)Cl)C

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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 C15H16Cl2N2O2S MW 359.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16Cl2N2O2S/c1-7(2)21-14(20)12-8(3)18-15(22)19-13(12)9-4-5-10(16)11(17)6-9/h4-7,13H,1-3H3,(H2,18,19,22)
InChIKey
OPBQVEUSCZTVHN-UHFFFAOYSA-N
Synonyms

CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)Cl)Cl)C(=O)OC(C)C
InChI=1SC15H16Cl2N2O2Sc17(2)2114(20)128(3)1815(22)1913(12)94510(16)11(17)69h4713H13H3(H2181922)
MFCD03226059
PROPAN2YL4(34DICHLOROPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
propan2yl4(34dichlorophenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
ZINC000001467669
ZINC000001467670

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.