Vitas-M small molecule compound
N-(4-methoxybenzyl)-2-[(2-methylbenzyl)sulfanyl]-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STL213656
SMILES COc1ccc(cc1)CNC(=O)c1nc(ncc1Sc1ccccc1)SCc1ccccc1C
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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 C27H25N3O2S2 MW 487.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O2S2/c1-19-8-6-7-9-21(19)18-33-27-29-17-24(34-23-10-4-3-5-11-23)25(30-27)26(31)28-16-20-12-14-22(32-2)15-13-20/h3-15,17H,16,18H2,1-2H3,(H,28,31)InChIKey
VMUSLTRNLODUMQ-UHFFFAOYSA-NSynonyms
CC1=CC=CC=C1CSC2=NC=C(C(=N2)C(=O)NCC3=CC=C(C=C3)OC)SC4=CC=CC=C4
InChI=1SC27H25N3O2S2c119867921(19)183327291724(3423104351123)25(3027)26(31)281620121422(322)151320h31517H1618H212H3(H2831)
MFCD18077830
N((4methoxyphenyl)methyl)2((2methylphenyl)methylsulfanyl)5phenylsulfanylpyrimidine4carboxamide
N(4methoxybenzyl)2((2methylbenzyl)sulfanyl)5(phenylsulfanyl)pyrimidine4carboxamide
ZINC000028404648
ZINC28404648
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