Vitas-M small molecule compound
ethyl 6-(3-bromo-4-methoxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
Catalog ID
STK036638
SMILES CCOC(=O)C1=C(C)N=C(NC1c1ccc(c(c1)Br)OC)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 C15H17BrN2O3S MW 385.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17BrN2O3S/c1-4-21-14(19)12-8(2)17-15(22)18-13(12)9-5-6-11(20-3)10(16)7-9/h5-7,13H,4H2,1-3H3,(H2,17,18,22)InChIKey
SNEVYIAHIJHQNF-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(C)N=C(NC1c1ccc(c(c1)Br)OC)S
CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C=C2)OC)Br)C
ETHYL4(3BROMO4METHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ETHYL6(3BROMO4METHOXYPHENYL)4METHYL2SULFANYL16DIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC15H17BrN2O3Sc142114(19)128(2)1715(22)1813(12)95611(203)10(16)79h5713H4H213H3(H2171822)
MFCD04086096
STK036638
ZINC000018323422
ZINC000018323425
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