Vitas-M small molecule compound
ethyl 4-methyl-6-[4-(propan-2-yl)phenyl]-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
Catalog ID
STK025382
SMILES CCOC(=O)C1=C(C)N=C(NC1c1ccc(cc1)C(C)C)S
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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 C17H22N2O2S MW 318.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O2S/c1-5-21-16(20)14-11(4)18-17(22)19-15(14)13-8-6-12(7-9-13)10(2)3/h6-10,15H,5H2,1-4H3,(H2,18,19,22)InChIKey
DUIOMFVCKKLGRW-UHFFFAOYSA-NSynonyms
314028-88-1314028881
CCOC(=O)C1=C(C)N=C(NC1c1ccc(cc1)C(C)C)S
CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)C(C)C)C
ETHYL4METHYL6(4(METHYLETHYL)PHENYL)2THIOXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
ETHYL4METHYL6(4(PROPAN2YL)PHENYL)2SULFANYL16DIHYDROPYRIMIDINE5CARBOXYLATE
ETHYL6METHYL4(4PROPAN2YLPHENYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
InChI=1SC17H22N2O2Sc152116(20)1411(4)1817(22)1915(14)138612(7913)10(2)3h61015H5H214H3(H2181922)
MFCD04085907
STK025382
ZINC000004592201
ZINC000004592202
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