Vitas-M small molecule compound

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

Catalog ID
STK802688
SMILES CC(OC(=O)C1=C(C)NC(=S)NC1c1cccs1)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 C13H16N2O2S2 MW 296.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O2S2/c1-7(2)17-12(16)10-8(3)14-13(18)15-11(10)9-5-4-6-19-9/h4-7,11H,1-3H3,(H2,14,15,18)
InChIKey
CORCKTORTRFHJU-UHFFFAOYSA-N
Synonyms
518982-84-8
518982848
CC1=C(C(NC(=S)N1)C2=CC=CS2)C(=O)OC(C)C
InChI=1SC13H16N2O2S2c17(2)1712(16)108(3)1413(18)1511(10)9546199h4711H13H3(H2141518)
MFCD03461756
PROPAN2YL6METHYL2SULFANYLIDENE4THIOPHEN2YL34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
propan2yl6methyl4(thiophen2yl)2thioxo1234tetrahydropyrimidine5carboxylate
ZINC000100837857
ZINC000100837858

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Available files

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