Vitas-M small molecule compound
methyl (2Z)-2-({[3-(4-methoxyphenyl)-1-methyl-1H-pyrazol-5-yl]carbonyl}imino)-5-phenyl-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL425380
SMILES COC(=O)c1[nH]/c(=N/C(=O)c2cc(nn2C)c2ccc(cc2)OC)/sc1c1ccccc1
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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 C23H20N4O4S MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O4S/c1-27-18(13-17(26-27)14-9-11-16(30-2)12-10-14)21(28)25-23-24-19(22(29)31-3)20(32-23)15-7-5-4-6-8-15/h4-13H,1-3H3,(H,24,25,28)InChIKey
IIWUIROISOBMRI-UHFFFAOYSA-NSynonyms
1630836-26-81630836268
CN1C(=CC(=N1)C2=CC=C(C=C2)OC)C(=O)NC3=NC(=C(S3)C4=CC=CC=C4)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)c2cc(nn2C)c2ccc(cc2)OC)sc1c1ccccc1
InChI=1SC23H20N4O4Sc12718(1317(2627)1491116(302)121014)21(28)25232419(22(29)313)20(3223)157546815h413H13H3(H242528)
methyl(2Z)2(((3(4methoxyphenyl)1methyl1Hpyrazol5yl)carbonyl)imino)5phenyl23dihydro13thiazole4carboxylate
methyl2((5(4methoxyphenyl)2methylpyrazole3carbonyl)amino)5phenyl13thiazole4carboxylate
MFCD30709947
ZINC000170622220
ZINC170622220
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